USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 914 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 163 SER OG : rot -131:sc= 0.855 USER MOD Set 1.2: B 165 THR OG1 : rot 180:sc= 0.674 USER MOD Set 2.1: A 67 TYR OH : rot 0:sc= 0.232 USER MOD Set 2.2: A 123 LYS NZ :NH3+ -121:sc= 0.21 (180deg=-0.146) USER MOD Set 2.3: A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 25 SER OG : rot 150:sc= 0 USER MOD Set 3.2: A 27 SER OG : rot 180:sc= 0.283 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 9 ASN : amide:sc=-0.00333 K(o=-0.0033,f=-1.3) USER MOD Single : A 13 THR OG1 : rot 64:sc= 1.2 USER MOD Single : A 16 SER OG : rot 77:sc= 1.08 USER MOD Single : A 18 LYS NZ :NH3+ -173:sc= 1.07 (180deg=0.97) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot -77:sc= 1.1 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= 0.887 K(o=0.89,f=-4.2!) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 168:sc= 1.04 (180deg=0.933) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 30:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= -0.0351 USER MOD Single : A 57 CYS SG : rot 102:sc= -0.142 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -1.6 K(o=-1.6,f=-2.9) USER MOD Single : A 62 LYS NZ :NH3+ 168:sc=-0.00914 (180deg=-0.172) USER MOD Single : A 65 SER OG : rot 140:sc= -0.148 USER MOD Single : A 71 SER OG : rot 70:sc= -0.711 USER MOD Single : A 76 TYR OH : rot 180:sc=-0.00933 USER MOD Single : A 80 THR OG1 : rot -149:sc= 0 USER MOD Single : A 93 THR OG1 : rot -3:sc= 0.731 USER MOD Single : A 94 CYS SG : rot 180:sc= -0.111 USER MOD Single : A 96 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 99 ASN : amide:sc=-0.00247 K(o=-0.0025,f=-1.2) USER MOD Single : A 100 THR OG1 : rot 70:sc= 1.2 USER MOD Single : A 106 GLN : amide:sc= 0.0123 K(o=0.012,f=-0.84) USER MOD Single : A 110 SER OG : rot 180:sc= -0.551 USER MOD Single : A 115 LYS NZ :NH3+ 146:sc= -0.954 (180deg=-2.2!) USER MOD Single : A 116 SER OG : rot -51:sc= 0.945 USER MOD Single : A 117 ASN : amide:sc= 0.317 K(o=0.32,f=-4.5!) USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 120 HIS : no HD1:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 161 SER OG : rot 180:sc= 0 USER MOD Single : B 162 TYR OH : rot 8:sc= 0.146 USER MOD ----------------------------------------------------------------- ATOM 78 N ASP A 6 -1.679 -6.466 20.545 1.00 0.00 N ATOM 79 CA ASP A 6 -1.306 -5.065 20.422 1.00 0.00 C ATOM 80 C ASP A 6 -0.740 -4.825 19.017 1.00 0.00 C ATOM 81 O ASP A 6 -1.066 -5.558 18.084 1.00 0.00 O ATOM 82 CB ASP A 6 -0.302 -4.743 21.534 1.00 0.00 C ATOM 83 CG ASP A 6 -0.123 -3.236 21.708 1.00 0.00 C ATOM 84 OD1 ASP A 6 -1.078 -2.597 22.205 1.00 0.00 O ATOM 85 OD2 ASP A 6 0.965 -2.741 21.345 1.00 0.00 O ATOM 0 HA ASP A 6 -2.162 -4.400 20.540 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -0.644 -5.180 22.472 1.00 0.00 H new ATOM 0 HB3 ASP A 6 0.660 -5.200 21.301 1.00 0.00 H new ATOM 90 N PHE A 7 0.108 -3.806 18.847 1.00 0.00 N ATOM 91 CA PHE A 7 0.754 -3.518 17.573 1.00 0.00 C ATOM 92 C PHE A 7 1.525 -4.741 17.066 1.00 0.00 C ATOM 93 O PHE A 7 1.928 -4.795 15.905 1.00 0.00 O ATOM 94 CB PHE A 7 1.681 -2.314 17.765 1.00 0.00 C ATOM 95 CG PHE A 7 2.199 -1.684 16.491 1.00 0.00 C ATOM 96 CD1 PHE A 7 1.359 -1.524 15.380 1.00 0.00 C ATOM 97 CD2 PHE A 7 3.531 -1.246 16.418 1.00 0.00 C ATOM 98 CE1 PHE A 7 1.839 -0.913 14.216 1.00 0.00 C ATOM 99 CE2 PHE A 7 4.013 -0.635 15.252 1.00 0.00 C ATOM 100 CZ PHE A 7 3.161 -0.461 14.154 1.00 0.00 C ATOM 0 H PHE A 7 0.363 -3.159 19.593 1.00 0.00 H new ATOM 0 HA PHE A 7 0.004 -3.281 16.819 1.00 0.00 H new ATOM 0 HB2 PHE A 7 1.148 -1.554 18.335 1.00 0.00 H new ATOM 0 HB3 PHE A 7 2.533 -2.626 18.369 1.00 0.00 H new ATOM 0 HD1 PHE A 7 0.338 -1.873 15.423 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.188 -1.381 17.265 1.00 0.00 H new ATOM 0 HE1 PHE A 7 1.187 -0.790 13.364 1.00 0.00 H new ATOM 0 HE2 PHE A 7 5.038 -0.299 15.201 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.525 0.022 13.259 1.00 0.00 H new ATOM 110 N GLN A 8 1.724 -5.723 17.949 1.00 0.00 N ATOM 111 CA GLN A 8 2.354 -6.988 17.636 1.00 0.00 C ATOM 112 C GLN A 8 1.677 -7.660 16.442 1.00 0.00 C ATOM 113 O GLN A 8 2.370 -8.261 15.627 1.00 0.00 O ATOM 114 CB GLN A 8 2.264 -7.873 18.883 1.00 0.00 C ATOM 115 CG GLN A 8 2.692 -9.310 18.584 1.00 0.00 C ATOM 116 CD GLN A 8 2.729 -10.166 19.845 1.00 0.00 C ATOM 117 OE1 GLN A 8 2.411 -9.707 20.938 1.00 0.00 O ATOM 118 NE2 GLN A 8 3.122 -11.431 19.706 1.00 0.00 N ATOM 0 H GLN A 8 1.440 -5.648 18.926 1.00 0.00 H new ATOM 0 HA GLN A 8 3.396 -6.828 17.359 1.00 0.00 H new ATOM 0 HB2 GLN A 8 2.896 -7.460 19.669 1.00 0.00 H new ATOM 0 HB3 GLN A 8 1.241 -7.868 19.261 1.00 0.00 H new ATOM 0 HG2 GLN A 8 2.002 -9.752 17.865 1.00 0.00 H new ATOM 0 HG3 GLN A 8 3.678 -9.306 18.119 1.00 0.00 H new ATOM 0 HE21 GLN A 8 3.381 -11.786 18.786 1.00 0.00 H new ATOM 0 HE22 GLN A 8 3.164 -12.044 20.520 1.00 0.00 H new ATOM 127 N ASN A 9 0.348 -7.577 16.313 1.00 0.00 N ATOM 128 CA ASN A 9 -0.318 -8.194 15.174 1.00 0.00 C ATOM 129 C ASN A 9 0.149 -7.544 13.877 1.00 0.00 C ATOM 130 O ASN A 9 0.443 -8.245 12.912 1.00 0.00 O ATOM 131 CB ASN A 9 -1.840 -8.093 15.314 1.00 0.00 C ATOM 132 CG ASN A 9 -2.362 -8.993 16.435 1.00 0.00 C ATOM 133 OD1 ASN A 9 -1.598 -9.694 17.090 1.00 0.00 O ATOM 134 ND2 ASN A 9 -3.670 -8.977 16.662 1.00 0.00 N ATOM 0 H ASN A 9 -0.270 -7.100 16.969 1.00 0.00 H new ATOM 0 HA ASN A 9 -0.053 -9.251 15.148 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -2.120 -7.059 15.516 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -2.312 -8.373 14.372 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -4.067 -9.559 17.399 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -4.278 -8.382 16.099 1.00 0.00 H new ATOM 141 N PHE A 10 0.222 -6.210 13.842 1.00 0.00 N ATOM 142 CA PHE A 10 0.625 -5.509 12.640 1.00 0.00 C ATOM 143 C PHE A 10 2.068 -5.853 12.275 1.00 0.00 C ATOM 144 O PHE A 10 2.350 -6.231 11.138 1.00 0.00 O ATOM 145 CB PHE A 10 0.449 -4.005 12.854 1.00 0.00 C ATOM 146 CG PHE A 10 0.747 -3.184 11.620 1.00 0.00 C ATOM 147 CD1 PHE A 10 2.067 -2.828 11.313 1.00 0.00 C ATOM 148 CD2 PHE A 10 -0.299 -2.773 10.783 1.00 0.00 C ATOM 149 CE1 PHE A 10 2.340 -2.080 10.159 1.00 0.00 C ATOM 150 CE2 PHE A 10 -0.028 -2.028 9.629 1.00 0.00 C ATOM 151 CZ PHE A 10 1.294 -1.688 9.316 1.00 0.00 C ATOM 0 H PHE A 10 0.006 -5.604 14.634 1.00 0.00 H new ATOM 0 HA PHE A 10 -0.004 -5.822 11.806 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -0.574 -3.808 13.174 1.00 0.00 H new ATOM 0 HB3 PHE A 10 1.104 -3.682 13.663 1.00 0.00 H new ATOM 0 HD1 PHE A 10 2.874 -3.130 11.965 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -1.318 -3.032 11.029 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.357 -1.806 9.921 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -0.835 -1.717 8.983 1.00 0.00 H new ATOM 0 HZ PHE A 10 1.507 -1.122 8.421 1.00 0.00 H new ATOM 161 N VAL A 11 2.988 -5.726 13.236 1.00 0.00 N ATOM 162 CA VAL A 11 4.395 -5.989 12.967 1.00 0.00 C ATOM 163 C VAL A 11 4.613 -7.456 12.614 1.00 0.00 C ATOM 164 O VAL A 11 5.237 -7.754 11.599 1.00 0.00 O ATOM 165 CB VAL A 11 5.250 -5.582 14.171 1.00 0.00 C ATOM 166 CG1 VAL A 11 6.725 -5.859 13.877 1.00 0.00 C ATOM 167 CG2 VAL A 11 5.093 -4.088 14.457 1.00 0.00 C ATOM 0 H VAL A 11 2.782 -5.446 14.195 1.00 0.00 H new ATOM 0 HA VAL A 11 4.702 -5.390 12.109 1.00 0.00 H new ATOM 0 HB VAL A 11 4.919 -6.160 15.034 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.328 -5.568 14.737 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.863 -6.922 13.680 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.036 -5.285 13.004 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.707 -3.815 15.315 1.00 0.00 H new ATOM 0 HG22 VAL A 11 5.412 -3.515 13.586 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.048 -3.867 14.674 1.00 0.00 H new ATOM 177 N ALA A 12 4.102 -8.373 13.441 1.00 0.00 N ATOM 178 CA ALA A 12 4.265 -9.799 13.214 1.00 0.00 C ATOM 179 C ALA A 12 3.633 -10.236 11.895 1.00 0.00 C ATOM 180 O ALA A 12 4.103 -11.196 11.286 1.00 0.00 O ATOM 181 CB ALA A 12 3.637 -10.568 14.377 1.00 0.00 C ATOM 0 H ALA A 12 3.568 -8.143 14.279 1.00 0.00 H new ATOM 0 HA ALA A 12 5.331 -10.018 13.154 1.00 0.00 H new ATOM 0 HB1 ALA A 12 3.756 -11.639 14.212 1.00 0.00 H new ATOM 0 HB2 ALA A 12 4.130 -10.287 15.308 1.00 0.00 H new ATOM 0 HB3 ALA A 12 2.576 -10.327 14.442 1.00 0.00 H new ATOM 187 N THR A 13 2.578 -9.555 11.438 1.00 0.00 N ATOM 188 CA THR A 13 1.987 -9.892 10.151 1.00 0.00 C ATOM 189 C THR A 13 2.882 -9.415 9.015 1.00 0.00 C ATOM 190 O THR A 13 3.086 -10.150 8.053 1.00 0.00 O ATOM 191 CB THR A 13 0.589 -9.292 10.021 1.00 0.00 C ATOM 192 OG1 THR A 13 -0.260 -9.868 10.986 1.00 0.00 O ATOM 193 CG2 THR A 13 0.013 -9.603 8.645 1.00 0.00 C ATOM 0 H THR A 13 2.127 -8.784 11.931 1.00 0.00 H new ATOM 0 HA THR A 13 1.897 -10.977 10.090 1.00 0.00 H new ATOM 0 HB THR A 13 0.659 -8.214 10.163 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.055 -9.630 11.883 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.984 -9.171 8.562 1.00 0.00 H new ATOM 0 HG22 THR A 13 0.658 -9.178 7.876 1.00 0.00 H new ATOM 0 HG23 THR A 13 -0.047 -10.683 8.511 1.00 0.00 H new ATOM 201 N LEU A 14 3.418 -8.193 9.110 1.00 0.00 N ATOM 202 CA LEU A 14 4.297 -7.673 8.073 1.00 0.00 C ATOM 203 C LEU A 14 5.595 -8.489 8.037 1.00 0.00 C ATOM 204 O LEU A 14 6.238 -8.615 6.998 1.00 0.00 O ATOM 205 CB LEU A 14 4.566 -6.188 8.345 1.00 0.00 C ATOM 206 CG LEU A 14 5.202 -5.458 7.156 1.00 0.00 C ATOM 207 CD1 LEU A 14 4.270 -5.406 5.946 1.00 0.00 C ATOM 208 CD2 LEU A 14 5.512 -4.028 7.587 1.00 0.00 C ATOM 0 H LEU A 14 3.257 -7.555 9.890 1.00 0.00 H new ATOM 0 HA LEU A 14 3.825 -7.762 7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.628 -5.698 8.603 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.222 -6.098 9.211 1.00 0.00 H new ATOM 0 HG LEU A 14 6.101 -6.000 6.865 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.763 -4.880 5.129 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.027 -6.421 5.630 1.00 0.00 H new ATOM 0 HD13 LEU A 14 3.354 -4.881 6.215 1.00 0.00 H new ATOM 0 HD21 LEU A 14 5.966 -3.488 6.756 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.589 -3.529 7.883 1.00 0.00 H new ATOM 0 HD23 LEU A 14 6.203 -4.044 8.430 1.00 0.00 H new ATOM 220 N GLU A 15 5.976 -9.048 9.190 1.00 0.00 N ATOM 221 CA GLU A 15 7.130 -9.930 9.321 1.00 0.00 C ATOM 222 C GLU A 15 6.828 -11.262 8.641 1.00 0.00 C ATOM 223 O GLU A 15 7.646 -11.776 7.882 1.00 0.00 O ATOM 224 CB GLU A 15 7.411 -10.177 10.805 1.00 0.00 C ATOM 225 CG GLU A 15 7.998 -8.952 11.500 1.00 0.00 C ATOM 226 CD GLU A 15 9.527 -8.989 11.496 1.00 0.00 C ATOM 227 OE1 GLU A 15 10.100 -9.277 10.420 1.00 0.00 O ATOM 228 OE2 GLU A 15 10.113 -8.728 12.571 1.00 0.00 O ATOM 0 H GLU A 15 5.481 -8.895 10.069 1.00 0.00 H new ATOM 0 HA GLU A 15 7.999 -9.467 8.853 1.00 0.00 H new ATOM 0 HB2 GLU A 15 6.486 -10.465 11.304 1.00 0.00 H new ATOM 0 HB3 GLU A 15 8.102 -11.014 10.906 1.00 0.00 H new ATOM 0 HG2 GLU A 15 7.653 -8.047 11.000 1.00 0.00 H new ATOM 0 HG3 GLU A 15 7.636 -8.906 12.527 1.00 0.00 H new ATOM 235 N SER A 16 5.643 -11.816 8.918 1.00 0.00 N ATOM 236 CA SER A 16 5.189 -13.031 8.263 1.00 0.00 C ATOM 237 C SER A 16 5.027 -12.789 6.766 1.00 0.00 C ATOM 238 O SER A 16 5.065 -13.731 5.980 1.00 0.00 O ATOM 239 CB SER A 16 3.862 -13.489 8.867 1.00 0.00 C ATOM 240 OG SER A 16 4.028 -13.777 10.242 1.00 0.00 O ATOM 0 H SER A 16 4.983 -11.434 9.596 1.00 0.00 H new ATOM 0 HA SER A 16 5.933 -13.813 8.415 1.00 0.00 H new ATOM 0 HB2 SER A 16 3.108 -12.713 8.738 1.00 0.00 H new ATOM 0 HB3 SER A 16 3.501 -14.374 8.343 1.00 0.00 H new ATOM 0 HG SER A 16 4.074 -12.939 10.748 1.00 0.00 H new ATOM 246 N PHE A 17 4.847 -11.525 6.368 1.00 0.00 N ATOM 247 CA PHE A 17 4.771 -11.152 4.967 1.00 0.00 C ATOM 248 C PHE A 17 6.167 -11.142 4.345 1.00 0.00 C ATOM 249 O PHE A 17 6.345 -11.566 3.205 1.00 0.00 O ATOM 250 CB PHE A 17 4.115 -9.774 4.858 1.00 0.00 C ATOM 251 CG PHE A 17 3.394 -9.561 3.543 1.00 0.00 C ATOM 252 CD1 PHE A 17 2.212 -10.266 3.280 1.00 0.00 C ATOM 253 CD2 PHE A 17 3.903 -8.671 2.591 1.00 0.00 C ATOM 254 CE1 PHE A 17 1.539 -10.085 2.066 1.00 0.00 C ATOM 255 CE2 PHE A 17 3.239 -8.499 1.369 1.00 0.00 C ATOM 256 CZ PHE A 17 2.055 -9.203 1.106 1.00 0.00 C ATOM 0 H PHE A 17 4.751 -10.740 7.012 1.00 0.00 H new ATOM 0 HA PHE A 17 4.170 -11.880 4.422 1.00 0.00 H new ATOM 0 HB2 PHE A 17 3.407 -9.649 5.678 1.00 0.00 H new ATOM 0 HB3 PHE A 17 4.878 -9.005 4.976 1.00 0.00 H new ATOM 0 HD1 PHE A 17 1.819 -10.951 4.016 1.00 0.00 H new ATOM 0 HD2 PHE A 17 4.807 -8.117 2.798 1.00 0.00 H new ATOM 0 HE1 PHE A 17 0.624 -10.624 1.869 1.00 0.00 H new ATOM 0 HE2 PHE A 17 3.640 -7.823 0.628 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.542 -9.066 0.166 1.00 0.00 H new ATOM 266 N LYS A 18 7.160 -10.655 5.101 1.00 0.00 N ATOM 267 CA LYS A 18 8.558 -10.657 4.684 1.00 0.00 C ATOM 268 C LYS A 18 9.124 -12.079 4.665 1.00 0.00 C ATOM 269 O LYS A 18 10.088 -12.353 3.954 1.00 0.00 O ATOM 270 CB LYS A 18 9.339 -9.737 5.625 1.00 0.00 C ATOM 271 CG LYS A 18 10.842 -9.764 5.341 1.00 0.00 C ATOM 272 CD LYS A 18 11.564 -8.618 6.052 1.00 0.00 C ATOM 273 CE LYS A 18 11.245 -8.575 7.546 1.00 0.00 C ATOM 274 NZ LYS A 18 11.706 -9.788 8.249 1.00 0.00 N ATOM 0 H LYS A 18 7.009 -10.247 6.024 1.00 0.00 H new ATOM 0 HA LYS A 18 8.648 -10.282 3.664 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.970 -8.717 5.523 1.00 0.00 H new ATOM 0 HB3 LYS A 18 9.160 -10.039 6.657 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.259 -10.717 5.667 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.012 -9.693 4.267 1.00 0.00 H new ATOM 0 HD2 LYS A 18 12.640 -8.728 5.915 1.00 0.00 H new ATOM 0 HD3 LYS A 18 11.279 -7.671 5.594 1.00 0.00 H new ATOM 0 HE2 LYS A 18 11.715 -7.698 7.991 1.00 0.00 H new ATOM 0 HE3 LYS A 18 10.169 -8.464 7.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 11.366 -9.770 9.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 11.332 -10.631 7.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 12.746 -9.819 8.243 1.00 0.00 H new ATOM 359 N ILE A 24 0.897 -13.530 -2.889 1.00 0.00 N ATOM 360 CA ILE A 24 0.243 -12.589 -1.990 1.00 0.00 C ATOM 361 C ILE A 24 -0.847 -13.346 -1.225 1.00 0.00 C ATOM 362 O ILE A 24 -1.384 -14.329 -1.734 1.00 0.00 O ATOM 363 CB ILE A 24 -0.340 -11.415 -2.790 1.00 0.00 C ATOM 364 CG1 ILE A 24 0.700 -10.848 -3.765 1.00 0.00 C ATOM 365 CG2 ILE A 24 -0.815 -10.311 -1.840 1.00 0.00 C ATOM 366 CD1 ILE A 24 0.123 -9.717 -4.624 1.00 0.00 C ATOM 0 HA ILE A 24 0.957 -12.171 -1.280 1.00 0.00 H new ATOM 0 HB ILE A 24 -1.189 -11.785 -3.364 1.00 0.00 H new ATOM 0 HG12 ILE A 24 1.558 -10.476 -3.205 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.063 -11.646 -4.412 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -1.226 -9.484 -2.419 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -1.584 -10.707 -1.177 1.00 0.00 H new ATOM 0 HG23 ILE A 24 0.027 -9.955 -1.247 1.00 0.00 H new ATOM 0 HD11 ILE A 24 0.893 -9.345 -5.300 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -0.718 -10.094 -5.205 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -0.216 -8.907 -3.979 1.00 0.00 H new ATOM 378 N SER A 25 -1.180 -12.901 -0.010 1.00 0.00 N ATOM 379 CA SER A 25 -2.263 -13.496 0.759 1.00 0.00 C ATOM 380 C SER A 25 -3.048 -12.402 1.464 1.00 0.00 C ATOM 381 O SER A 25 -2.481 -11.596 2.203 1.00 0.00 O ATOM 382 CB SER A 25 -1.710 -14.528 1.739 1.00 0.00 C ATOM 383 OG SER A 25 -2.783 -15.083 2.473 1.00 0.00 O ATOM 0 H SER A 25 -0.709 -12.127 0.459 1.00 0.00 H new ATOM 0 HA SER A 25 -2.946 -14.020 0.090 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.177 -15.311 1.200 1.00 0.00 H new ATOM 0 HB3 SER A 25 -0.993 -14.061 2.414 1.00 0.00 H new ATOM 0 HG SER A 25 -2.566 -16.006 2.722 1.00 0.00 H new ATOM 389 N GLY A 26 -4.363 -12.378 1.233 1.00 0.00 N ATOM 390 CA GLY A 26 -5.248 -11.352 1.751 1.00 0.00 C ATOM 391 C GLY A 26 -5.276 -11.310 3.274 1.00 0.00 C ATOM 392 O GLY A 26 -5.462 -10.240 3.840 1.00 0.00 O ATOM 0 H GLY A 26 -4.841 -13.083 0.673 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -4.932 -10.380 1.371 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -6.257 -11.527 1.378 1.00 0.00 H new ATOM 396 N SER A 27 -5.092 -12.445 3.952 1.00 0.00 N ATOM 397 CA SER A 27 -5.215 -12.487 5.402 1.00 0.00 C ATOM 398 C SER A 27 -4.155 -11.612 6.063 1.00 0.00 C ATOM 399 O SER A 27 -4.418 -10.989 7.092 1.00 0.00 O ATOM 400 CB SER A 27 -5.116 -13.933 5.883 1.00 0.00 C ATOM 401 OG SER A 27 -3.825 -14.442 5.617 1.00 0.00 O ATOM 0 H SER A 27 -4.859 -13.339 3.520 1.00 0.00 H new ATOM 0 HA SER A 27 -6.189 -12.090 5.688 1.00 0.00 H new ATOM 0 HB2 SER A 27 -5.323 -13.985 6.952 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.867 -14.544 5.383 1.00 0.00 H new ATOM 0 HG SER A 27 -3.768 -15.369 5.929 1.00 0.00 H new ATOM 407 N ARG A 28 -2.958 -11.563 5.472 1.00 0.00 N ATOM 408 CA ARG A 28 -1.887 -10.728 5.984 1.00 0.00 C ATOM 409 C ARG A 28 -2.270 -9.264 5.776 1.00 0.00 C ATOM 410 O ARG A 28 -2.122 -8.435 6.672 1.00 0.00 O ATOM 411 CB ARG A 28 -0.579 -11.060 5.260 1.00 0.00 C ATOM 412 CG ARG A 28 -0.296 -12.566 5.138 1.00 0.00 C ATOM 413 CD ARG A 28 -0.354 -13.296 6.482 1.00 0.00 C ATOM 414 NE ARG A 28 0.283 -14.620 6.398 1.00 0.00 N ATOM 415 CZ ARG A 28 -0.180 -15.668 5.707 1.00 0.00 C ATOM 416 NH1 ARG A 28 -1.325 -15.610 5.033 1.00 0.00 N ATOM 417 NH2 ARG A 28 0.513 -16.803 5.687 1.00 0.00 N ATOM 0 H ARG A 28 -2.714 -12.096 4.637 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.738 -10.912 7.048 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -0.608 -10.624 4.261 1.00 0.00 H new ATOM 0 HB3 ARG A 28 0.248 -10.587 5.790 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -1.021 -13.012 4.457 1.00 0.00 H new ATOM 0 HG3 ARG A 28 0.689 -12.710 4.695 1.00 0.00 H new ATOM 0 HD2 ARG A 28 0.144 -12.698 7.245 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -1.393 -13.409 6.793 1.00 0.00 H new ATOM 0 HE ARG A 28 1.154 -14.750 6.912 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -1.875 -14.751 5.034 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.654 -16.425 4.515 1.00 0.00 H new ATOM 0 HH21 ARG A 28 1.394 -16.872 6.197 1.00 0.00 H new ATOM 0 HH22 ARG A 28 0.164 -17.605 5.162 1.00 0.00 H new ATOM 431 N ILE A 29 -2.766 -8.953 4.577 1.00 0.00 N ATOM 432 CA ILE A 29 -3.190 -7.608 4.229 1.00 0.00 C ATOM 433 C ILE A 29 -4.349 -7.189 5.132 1.00 0.00 C ATOM 434 O ILE A 29 -4.456 -6.022 5.503 1.00 0.00 O ATOM 435 CB ILE A 29 -3.580 -7.569 2.741 1.00 0.00 C ATOM 436 CG1 ILE A 29 -2.419 -8.106 1.891 1.00 0.00 C ATOM 437 CG2 ILE A 29 -3.930 -6.132 2.343 1.00 0.00 C ATOM 438 CD1 ILE A 29 -2.711 -8.069 0.393 1.00 0.00 C ATOM 0 H ILE A 29 -2.883 -9.631 3.824 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.376 -6.900 4.383 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.453 -8.199 2.569 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.524 -7.519 2.096 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.202 -9.132 2.188 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -4.206 -6.103 1.289 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.766 -5.781 2.947 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -3.067 -5.488 2.509 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.854 -8.461 -0.155 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -3.588 -8.679 0.178 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -2.899 -7.041 0.084 1.00 0.00 H new ATOM 450 N LYS A 30 -5.219 -8.138 5.493 1.00 0.00 N ATOM 451 CA LYS A 30 -6.369 -7.872 6.341 1.00 0.00 C ATOM 452 C LYS A 30 -5.943 -7.596 7.780 1.00 0.00 C ATOM 453 O LYS A 30 -6.541 -6.737 8.424 1.00 0.00 O ATOM 454 CB LYS A 30 -7.371 -9.026 6.236 1.00 0.00 C ATOM 455 CG LYS A 30 -8.094 -8.976 4.886 1.00 0.00 C ATOM 456 CD LYS A 30 -9.100 -7.825 4.821 1.00 0.00 C ATOM 457 CE LYS A 30 -9.488 -7.609 3.361 1.00 0.00 C ATOM 458 NZ LYS A 30 -10.434 -6.487 3.218 1.00 0.00 N ATOM 0 H LYS A 30 -5.139 -9.112 5.201 1.00 0.00 H new ATOM 0 HA LYS A 30 -6.867 -6.967 5.993 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.853 -9.979 6.344 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.096 -8.963 7.048 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -7.362 -8.864 4.086 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -8.611 -9.920 4.716 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -9.982 -8.058 5.418 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -8.665 -6.916 5.237 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -8.594 -7.411 2.770 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -9.937 -8.519 2.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -10.679 -6.365 2.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -11.297 -6.689 3.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -9.995 -5.615 3.576 1.00 0.00 H new ATOM 472 N LYS A 31 -4.927 -8.296 8.304 1.00 0.00 N ATOM 473 CA LYS A 31 -4.414 -7.992 9.642 1.00 0.00 C ATOM 474 C LYS A 31 -3.779 -6.602 9.660 1.00 0.00 C ATOM 475 O LYS A 31 -3.987 -5.837 10.606 1.00 0.00 O ATOM 476 CB LYS A 31 -3.395 -9.050 10.080 1.00 0.00 C ATOM 477 CG LYS A 31 -3.822 -9.747 11.374 1.00 0.00 C ATOM 478 CD LYS A 31 -5.103 -10.572 11.215 1.00 0.00 C ATOM 479 CE LYS A 31 -4.890 -11.725 10.234 1.00 0.00 C ATOM 480 NZ LYS A 31 -6.117 -12.534 10.097 1.00 0.00 N ATOM 0 H LYS A 31 -4.452 -9.064 7.829 1.00 0.00 H new ATOM 0 HA LYS A 31 -5.247 -8.005 10.345 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.277 -9.791 9.289 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -2.422 -8.580 10.224 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.016 -10.399 11.712 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.973 -8.998 12.151 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -5.410 -10.966 12.184 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.911 -9.932 10.861 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -4.599 -11.330 9.260 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.071 -12.355 10.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -5.948 -13.310 9.426 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.378 -12.928 11.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -6.891 -11.935 9.745 1.00 0.00 H new ATOM 494 N LEU A 32 -3.006 -6.270 8.622 1.00 0.00 N ATOM 495 CA LEU A 32 -2.354 -4.971 8.538 1.00 0.00 C ATOM 496 C LEU A 32 -3.381 -3.844 8.441 1.00 0.00 C ATOM 497 O LEU A 32 -3.414 -2.962 9.299 1.00 0.00 O ATOM 498 CB LEU A 32 -1.385 -4.961 7.352 1.00 0.00 C ATOM 499 CG LEU A 32 -0.209 -5.920 7.568 1.00 0.00 C ATOM 500 CD1 LEU A 32 0.610 -6.004 6.287 1.00 0.00 C ATOM 501 CD2 LEU A 32 0.703 -5.439 8.690 1.00 0.00 C ATOM 0 H LEU A 32 -2.820 -6.886 7.831 1.00 0.00 H new ATOM 0 HA LEU A 32 -1.784 -4.798 9.451 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.919 -5.240 6.444 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -1.006 -3.950 7.201 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.615 -6.895 7.838 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.448 -6.685 6.435 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.019 -6.373 5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.988 -5.014 6.031 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.526 -6.142 8.816 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.101 -4.456 8.439 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.135 -5.375 9.618 1.00 0.00 H new ATOM 513 N THR A 33 -4.225 -3.861 7.405 1.00 0.00 N ATOM 514 CA THR A 33 -5.258 -2.854 7.226 1.00 0.00 C ATOM 515 C THR A 33 -6.188 -2.747 8.426 1.00 0.00 C ATOM 516 O THR A 33 -6.478 -1.642 8.879 1.00 0.00 O ATOM 517 CB THR A 33 -6.082 -3.188 5.987 1.00 0.00 C ATOM 518 OG1 THR A 33 -6.627 -4.483 6.075 1.00 0.00 O ATOM 519 CG2 THR A 33 -5.204 -3.114 4.747 1.00 0.00 C ATOM 0 H THR A 33 -4.206 -4.572 6.674 1.00 0.00 H new ATOM 0 HA THR A 33 -4.755 -1.894 7.113 1.00 0.00 H new ATOM 0 HB THR A 33 -6.893 -2.463 5.921 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.930 -5.145 5.884 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.799 -3.354 3.865 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.798 -2.107 4.648 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.385 -3.828 4.838 1.00 0.00 H new ATOM 527 N THR A 34 -6.668 -3.873 8.955 1.00 0.00 N ATOM 528 CA THR A 34 -7.610 -3.808 10.065 1.00 0.00 C ATOM 529 C THR A 34 -6.973 -3.177 11.294 1.00 0.00 C ATOM 530 O THR A 34 -7.601 -2.334 11.929 1.00 0.00 O ATOM 531 CB THR A 34 -8.219 -5.182 10.373 1.00 0.00 C ATOM 532 OG1 THR A 34 -9.446 -4.992 11.044 1.00 0.00 O ATOM 533 CG2 THR A 34 -7.331 -6.063 11.252 1.00 0.00 C ATOM 0 H THR A 34 -6.427 -4.814 8.642 1.00 0.00 H new ATOM 0 HA THR A 34 -8.433 -3.161 9.761 1.00 0.00 H new ATOM 0 HB THR A 34 -8.341 -5.692 9.418 1.00 0.00 H new ATOM 0 HG1 THR A 34 -9.847 -5.863 11.246 1.00 0.00 H new ATOM 0 HG21 THR A 34 -7.826 -7.018 11.428 1.00 0.00 H new ATOM 0 HG22 THR A 34 -6.379 -6.235 10.750 1.00 0.00 H new ATOM 0 HG23 THR A 34 -7.154 -5.565 12.205 1.00 0.00 H new ATOM 541 N TYR A 35 -5.739 -3.560 11.650 1.00 0.00 N ATOM 542 CA TYR A 35 -5.138 -2.979 12.840 1.00 0.00 C ATOM 543 C TYR A 35 -4.852 -1.492 12.642 1.00 0.00 C ATOM 544 O TYR A 35 -4.989 -0.713 13.582 1.00 0.00 O ATOM 545 CB TYR A 35 -3.880 -3.738 13.260 1.00 0.00 C ATOM 546 CG TYR A 35 -3.446 -3.317 14.649 1.00 0.00 C ATOM 547 CD1 TYR A 35 -3.950 -3.994 15.768 1.00 0.00 C ATOM 548 CD2 TYR A 35 -2.554 -2.246 14.819 1.00 0.00 C ATOM 549 CE1 TYR A 35 -3.596 -3.581 17.061 1.00 0.00 C ATOM 550 CE2 TYR A 35 -2.199 -1.826 16.108 1.00 0.00 C ATOM 551 CZ TYR A 35 -2.728 -2.487 17.236 1.00 0.00 C ATOM 552 OH TYR A 35 -2.400 -2.059 18.489 1.00 0.00 O ATOM 0 H TYR A 35 -5.165 -4.240 11.151 1.00 0.00 H new ATOM 0 HA TYR A 35 -5.859 -3.073 13.652 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -4.072 -4.811 13.242 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -3.077 -3.546 12.548 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -4.613 -4.836 15.634 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -2.141 -1.745 13.956 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -3.989 -4.102 17.921 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -1.520 -0.996 16.238 1.00 0.00 H new ATOM 0 HH TYR A 35 -1.790 -1.295 18.424 1.00 0.00 H new ATOM 562 N ALA A 36 -4.458 -1.088 11.428 1.00 0.00 N ATOM 563 CA ALA A 36 -4.287 0.318 11.116 1.00 0.00 C ATOM 564 C ALA A 36 -5.598 1.076 11.331 1.00 0.00 C ATOM 565 O ALA A 36 -5.653 2.029 12.105 1.00 0.00 O ATOM 566 CB ALA A 36 -3.806 0.442 9.671 1.00 0.00 C ATOM 0 H ALA A 36 -4.255 -1.721 10.654 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.544 0.760 11.780 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.673 1.495 9.421 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.856 -0.081 9.557 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.545 0.001 9.002 1.00 0.00 H new ATOM 572 N LEU A 37 -6.652 0.643 10.637 1.00 0.00 N ATOM 573 CA LEU A 37 -7.945 1.305 10.629 1.00 0.00 C ATOM 574 C LEU A 37 -8.694 1.172 11.956 1.00 0.00 C ATOM 575 O LEU A 37 -9.641 1.923 12.195 1.00 0.00 O ATOM 576 CB LEU A 37 -8.771 0.732 9.474 1.00 0.00 C ATOM 577 CG LEU A 37 -8.087 0.962 8.122 1.00 0.00 C ATOM 578 CD1 LEU A 37 -8.793 0.148 7.042 1.00 0.00 C ATOM 579 CD2 LEU A 37 -8.120 2.438 7.732 1.00 0.00 C ATOM 0 H LEU A 37 -6.624 -0.195 10.055 1.00 0.00 H new ATOM 0 HA LEU A 37 -7.783 2.374 10.491 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -8.922 -0.336 9.629 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.758 1.195 9.467 1.00 0.00 H new ATOM 0 HG LEU A 37 -7.048 0.646 8.213 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -8.303 0.315 6.082 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.745 -0.911 7.295 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -9.836 0.458 6.976 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.628 2.571 6.769 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.155 2.772 7.660 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.601 3.026 8.489 1.00 0.00 H new ATOM 591 N ASP A 38 -8.292 0.234 12.818 1.00 0.00 N ATOM 592 CA ASP A 38 -8.959 0.016 14.098 1.00 0.00 C ATOM 593 C ASP A 38 -8.900 1.234 15.028 1.00 0.00 C ATOM 594 O ASP A 38 -9.810 1.414 15.833 1.00 0.00 O ATOM 595 CB ASP A 38 -8.346 -1.206 14.783 1.00 0.00 C ATOM 596 CG ASP A 38 -9.036 -1.509 16.113 1.00 0.00 C ATOM 597 OD1 ASP A 38 -10.203 -1.957 16.067 1.00 0.00 O ATOM 598 OD2 ASP A 38 -8.388 -1.289 17.159 1.00 0.00 O ATOM 0 H ASP A 38 -7.502 -0.389 12.648 1.00 0.00 H new ATOM 0 HA ASP A 38 -10.015 -0.154 13.889 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -8.426 -2.071 14.125 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -7.284 -1.033 14.954 1.00 0.00 H new ATOM 603 N HIS A 39 -7.861 2.073 14.947 1.00 0.00 N ATOM 604 CA HIS A 39 -7.771 3.210 15.861 1.00 0.00 C ATOM 605 C HIS A 39 -6.996 4.417 15.327 1.00 0.00 C ATOM 606 O HIS A 39 -7.142 5.502 15.884 1.00 0.00 O ATOM 607 CB HIS A 39 -7.169 2.741 17.190 1.00 0.00 C ATOM 608 CG HIS A 39 -5.795 2.140 17.061 1.00 0.00 C ATOM 609 ND1 HIS A 39 -4.589 2.819 17.258 1.00 0.00 N ATOM 610 CD2 HIS A 39 -5.530 0.840 16.736 1.00 0.00 C ATOM 611 CE1 HIS A 39 -3.628 1.903 17.053 1.00 0.00 C ATOM 612 NE2 HIS A 39 -4.162 0.711 16.731 1.00 0.00 N ATOM 0 H HIS A 39 -7.094 1.989 14.279 1.00 0.00 H new ATOM 0 HA HIS A 39 -8.792 3.570 15.991 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -7.121 3.588 17.874 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -7.836 2.005 17.640 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -6.253 0.066 16.525 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.569 2.097 17.136 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -3.642 -0.141 16.520 1.00 0.00 H new ATOM 620 N ILE A 40 -6.188 4.250 14.273 1.00 0.00 N ATOM 621 CA ILE A 40 -5.434 5.338 13.656 1.00 0.00 C ATOM 622 C ILE A 40 -4.754 6.233 14.700 1.00 0.00 C ATOM 623 O ILE A 40 -5.210 7.335 15.001 1.00 0.00 O ATOM 624 CB ILE A 40 -6.339 6.123 12.693 1.00 0.00 C ATOM 625 CG1 ILE A 40 -6.957 5.198 11.634 1.00 0.00 C ATOM 626 CG2 ILE A 40 -5.548 7.232 11.993 1.00 0.00 C ATOM 627 CD1 ILE A 40 -5.912 4.668 10.652 1.00 0.00 C ATOM 0 H ILE A 40 -6.041 3.346 13.824 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.621 4.909 13.071 1.00 0.00 H new ATOM 0 HB ILE A 40 -7.140 6.566 13.285 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -7.448 4.359 12.128 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -7.727 5.740 11.085 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -6.206 7.776 11.316 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.146 7.919 12.738 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.728 6.792 11.426 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.395 4.019 9.922 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.439 5.504 10.137 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -5.155 4.102 11.196 1.00 0.00 H new ATOM 639 N ASP A 41 -3.645 5.747 15.261 1.00 0.00 N ATOM 640 CA ASP A 41 -2.877 6.463 16.272 1.00 0.00 C ATOM 641 C ASP A 41 -1.384 6.135 16.140 1.00 0.00 C ATOM 642 O ASP A 41 -0.610 6.297 17.080 1.00 0.00 O ATOM 643 CB ASP A 41 -3.403 6.087 17.660 1.00 0.00 C ATOM 644 CG ASP A 41 -2.810 6.971 18.759 1.00 0.00 C ATOM 645 OD1 ASP A 41 -2.809 8.209 18.576 1.00 0.00 O ATOM 646 OD2 ASP A 41 -2.360 6.400 19.777 1.00 0.00 O ATOM 0 H ASP A 41 -3.254 4.836 15.021 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.993 7.537 16.129 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -4.489 6.175 17.672 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -3.165 5.044 17.867 1.00 0.00 H new ATOM 651 N ILE A 42 -0.984 5.666 14.954 1.00 0.00 N ATOM 652 CA ILE A 42 0.344 5.141 14.684 1.00 0.00 C ATOM 653 C ILE A 42 0.728 5.453 13.237 1.00 0.00 C ATOM 654 O ILE A 42 1.362 4.650 12.560 1.00 0.00 O ATOM 655 CB ILE A 42 0.415 3.632 14.987 1.00 0.00 C ATOM 656 CG1 ILE A 42 -0.952 2.957 14.829 1.00 0.00 C ATOM 657 CG2 ILE A 42 0.984 3.406 16.389 1.00 0.00 C ATOM 658 CD1 ILE A 42 -0.816 1.441 14.941 1.00 0.00 C ATOM 0 H ILE A 42 -1.596 5.644 14.139 1.00 0.00 H new ATOM 0 HA ILE A 42 1.065 5.625 15.343 1.00 0.00 H new ATOM 0 HB ILE A 42 1.083 3.170 14.260 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.636 3.324 15.594 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -1.384 3.219 13.863 1.00 0.00 H new ATOM 0 HG21 ILE A 42 1.031 2.337 16.595 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.986 3.831 16.448 1.00 0.00 H new ATOM 0 HG23 ILE A 42 0.341 3.889 17.125 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.796 0.978 14.826 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -0.149 1.077 14.159 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -0.405 1.184 15.917 1.00 0.00 H new ATOM 670 N GLU A 43 0.338 6.635 12.762 1.00 0.00 N ATOM 671 CA GLU A 43 0.533 7.054 11.387 1.00 0.00 C ATOM 672 C GLU A 43 1.970 6.891 10.889 1.00 0.00 C ATOM 673 O GLU A 43 2.204 6.199 9.897 1.00 0.00 O ATOM 674 CB GLU A 43 0.041 8.502 11.236 1.00 0.00 C ATOM 675 CG GLU A 43 0.779 9.552 12.077 1.00 0.00 C ATOM 676 CD GLU A 43 0.749 9.244 13.573 1.00 0.00 C ATOM 677 OE1 GLU A 43 -0.337 9.407 14.172 1.00 0.00 O ATOM 678 OE2 GLU A 43 1.809 8.850 14.103 1.00 0.00 O ATOM 0 H GLU A 43 -0.130 7.336 13.337 1.00 0.00 H new ATOM 0 HA GLU A 43 -0.055 6.391 10.752 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.120 8.784 10.186 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -1.017 8.535 11.496 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.815 9.613 11.745 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.330 10.530 11.904 1.00 0.00 H new ATOM 685 N SER A 44 2.939 7.515 11.558 1.00 0.00 N ATOM 686 CA SER A 44 4.316 7.535 11.084 1.00 0.00 C ATOM 687 C SER A 44 5.023 6.199 11.284 1.00 0.00 C ATOM 688 O SER A 44 5.961 5.892 10.551 1.00 0.00 O ATOM 689 CB SER A 44 5.073 8.660 11.786 1.00 0.00 C ATOM 690 OG SER A 44 5.085 8.439 13.180 1.00 0.00 O ATOM 0 H SER A 44 2.791 8.015 12.435 1.00 0.00 H new ATOM 0 HA SER A 44 4.300 7.715 10.009 1.00 0.00 H new ATOM 0 HB2 SER A 44 6.094 8.712 11.409 1.00 0.00 H new ATOM 0 HB3 SER A 44 4.603 9.618 11.566 1.00 0.00 H new ATOM 0 HG SER A 44 5.574 9.164 13.622 1.00 0.00 H new ATOM 696 N LYS A 45 4.588 5.404 12.262 1.00 0.00 N ATOM 697 CA LYS A 45 5.189 4.114 12.537 1.00 0.00 C ATOM 698 C LYS A 45 4.626 3.064 11.583 1.00 0.00 C ATOM 699 O LYS A 45 5.390 2.275 11.033 1.00 0.00 O ATOM 700 CB LYS A 45 5.063 3.743 14.028 1.00 0.00 C ATOM 701 CG LYS A 45 3.846 4.294 14.768 1.00 0.00 C ATOM 702 CD LYS A 45 3.819 5.826 14.883 1.00 0.00 C ATOM 703 CE LYS A 45 3.366 6.279 16.265 1.00 0.00 C ATOM 704 NZ LYS A 45 3.258 7.751 16.324 1.00 0.00 N ATOM 0 H LYS A 45 3.812 5.642 12.879 1.00 0.00 H new ATOM 0 HA LYS A 45 6.261 4.162 12.348 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.048 2.656 14.109 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.960 4.088 14.542 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.943 3.963 14.255 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.819 3.865 15.770 1.00 0.00 H new ATOM 0 HD2 LYS A 45 4.813 6.224 14.677 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.149 6.236 14.128 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.402 5.829 16.502 1.00 0.00 H new ATOM 0 HE3 LYS A 45 4.074 5.931 17.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.760 8.028 17.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 4.210 8.169 16.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.728 8.094 15.497 1.00 0.00 H new ATOM 718 N ILE A 46 3.304 3.042 11.376 1.00 0.00 N ATOM 719 CA ILE A 46 2.705 2.177 10.369 1.00 0.00 C ATOM 720 C ILE A 46 3.344 2.455 9.011 1.00 0.00 C ATOM 721 O ILE A 46 3.786 1.530 8.329 1.00 0.00 O ATOM 722 CB ILE A 46 1.191 2.424 10.315 1.00 0.00 C ATOM 723 CG1 ILE A 46 0.530 1.697 11.491 1.00 0.00 C ATOM 724 CG2 ILE A 46 0.561 1.944 9.003 1.00 0.00 C ATOM 725 CD1 ILE A 46 -0.987 1.910 11.514 1.00 0.00 C ATOM 0 H ILE A 46 2.636 3.613 11.893 1.00 0.00 H new ATOM 0 HA ILE A 46 2.879 1.133 10.629 1.00 0.00 H new ATOM 0 HB ILE A 46 1.028 3.500 10.376 1.00 0.00 H new ATOM 0 HG12 ILE A 46 0.746 0.631 11.426 1.00 0.00 H new ATOM 0 HG13 ILE A 46 0.961 2.053 12.427 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -0.510 2.144 9.020 1.00 0.00 H new ATOM 0 HG22 ILE A 46 1.016 2.474 8.166 1.00 0.00 H new ATOM 0 HG23 ILE A 46 0.729 0.873 8.889 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.416 1.378 12.363 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.204 2.974 11.606 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.422 1.529 10.590 1.00 0.00 H new ATOM 737 N ILE A 47 3.396 3.732 8.615 1.00 0.00 N ATOM 738 CA ILE A 47 3.912 4.098 7.304 1.00 0.00 C ATOM 739 C ILE A 47 5.411 3.839 7.183 1.00 0.00 C ATOM 740 O ILE A 47 5.839 3.244 6.197 1.00 0.00 O ATOM 741 CB ILE A 47 3.552 5.553 6.994 1.00 0.00 C ATOM 742 CG1 ILE A 47 2.046 5.705 6.758 1.00 0.00 C ATOM 743 CG2 ILE A 47 4.301 6.036 5.756 1.00 0.00 C ATOM 744 CD1 ILE A 47 1.469 4.701 5.759 1.00 0.00 C ATOM 0 H ILE A 47 3.088 4.520 9.184 1.00 0.00 H new ATOM 0 HA ILE A 47 3.439 3.460 6.558 1.00 0.00 H new ATOM 0 HB ILE A 47 3.842 6.156 7.855 1.00 0.00 H new ATOM 0 HG12 ILE A 47 1.526 5.595 7.710 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.845 6.715 6.400 1.00 0.00 H new ATOM 0 HG21 ILE A 47 4.033 7.072 5.550 1.00 0.00 H new ATOM 0 HG22 ILE A 47 5.375 5.966 5.930 1.00 0.00 H new ATOM 0 HG23 ILE A 47 4.031 5.415 4.902 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.399 4.874 5.647 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.960 4.825 4.794 1.00 0.00 H new ATOM 0 HD13 ILE A 47 1.637 3.688 6.124 1.00 0.00 H new ATOM 756 N SER A 48 6.215 4.269 8.157 1.00 0.00 N ATOM 757 CA SER A 48 7.650 4.022 8.079 1.00 0.00 C ATOM 758 C SER A 48 7.913 2.529 7.913 1.00 0.00 C ATOM 759 O SER A 48 8.762 2.131 7.113 1.00 0.00 O ATOM 760 CB SER A 48 8.326 4.549 9.341 1.00 0.00 C ATOM 761 OG SER A 48 9.717 4.319 9.274 1.00 0.00 O ATOM 0 H SER A 48 5.906 4.776 8.986 1.00 0.00 H new ATOM 0 HA SER A 48 8.063 4.542 7.214 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.130 5.616 9.450 1.00 0.00 H new ATOM 0 HB3 SER A 48 7.909 4.057 10.220 1.00 0.00 H new ATOM 0 HG SER A 48 10.145 4.661 10.087 1.00 0.00 H new ATOM 767 N LEU A 49 7.182 1.699 8.671 1.00 0.00 N ATOM 768 CA LEU A 49 7.350 0.261 8.588 1.00 0.00 C ATOM 769 C LEU A 49 7.028 -0.247 7.188 1.00 0.00 C ATOM 770 O LEU A 49 7.915 -0.793 6.543 1.00 0.00 O ATOM 771 CB LEU A 49 6.513 -0.449 9.650 1.00 0.00 C ATOM 772 CG LEU A 49 7.100 -0.281 11.056 1.00 0.00 C ATOM 773 CD1 LEU A 49 6.119 -0.862 12.069 1.00 0.00 C ATOM 774 CD2 LEU A 49 8.423 -1.027 11.198 1.00 0.00 C ATOM 0 H LEU A 49 6.477 2.006 9.340 1.00 0.00 H new ATOM 0 HA LEU A 49 8.397 0.030 8.787 1.00 0.00 H new ATOM 0 HB2 LEU A 49 5.497 -0.055 9.633 1.00 0.00 H new ATOM 0 HB3 LEU A 49 6.448 -1.510 9.410 1.00 0.00 H new ATOM 0 HG LEU A 49 7.272 0.781 11.229 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.525 -0.749 13.074 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.168 -0.333 12.000 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.962 -1.920 11.858 1.00 0.00 H new ATOM 0 HD21 LEU A 49 8.813 -0.888 12.206 1.00 0.00 H new ATOM 0 HD22 LEU A 49 8.263 -2.089 11.014 1.00 0.00 H new ATOM 0 HD23 LEU A 49 9.140 -0.638 10.475 1.00 0.00 H new ATOM 786 N ILE A 50 5.794 -0.088 6.694 1.00 0.00 N ATOM 787 CA ILE A 50 5.450 -0.689 5.406 1.00 0.00 C ATOM 788 C ILE A 50 6.353 -0.187 4.275 1.00 0.00 C ATOM 789 O ILE A 50 6.680 -0.956 3.371 1.00 0.00 O ATOM 790 CB ILE A 50 3.970 -0.473 5.070 1.00 0.00 C ATOM 791 CG1 ILE A 50 3.702 1.016 4.851 1.00 0.00 C ATOM 792 CG2 ILE A 50 3.090 -1.066 6.175 1.00 0.00 C ATOM 793 CD1 ILE A 50 2.229 1.323 4.576 1.00 0.00 C ATOM 0 H ILE A 50 5.044 0.432 7.149 1.00 0.00 H new ATOM 0 HA ILE A 50 5.622 -1.761 5.500 1.00 0.00 H new ATOM 0 HB ILE A 50 3.719 -0.991 4.144 1.00 0.00 H new ATOM 0 HG12 ILE A 50 4.025 1.571 5.732 1.00 0.00 H new ATOM 0 HG13 ILE A 50 4.304 1.369 4.013 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.040 -0.908 5.928 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.286 -2.135 6.262 1.00 0.00 H new ATOM 0 HG23 ILE A 50 3.317 -0.578 7.123 1.00 0.00 H new ATOM 0 HD11 ILE A 50 2.102 2.396 4.429 1.00 0.00 H new ATOM 0 HD12 ILE A 50 1.908 0.793 3.679 1.00 0.00 H new ATOM 0 HD13 ILE A 50 1.625 0.999 5.424 1.00 0.00 H new ATOM 805 N ILE A 51 6.763 1.089 4.311 1.00 0.00 N ATOM 806 CA ILE A 51 7.650 1.634 3.296 1.00 0.00 C ATOM 807 C ILE A 51 8.964 0.865 3.305 1.00 0.00 C ATOM 808 O ILE A 51 9.357 0.274 2.300 1.00 0.00 O ATOM 809 CB ILE A 51 7.918 3.117 3.566 1.00 0.00 C ATOM 810 CG1 ILE A 51 6.656 3.935 3.278 1.00 0.00 C ATOM 811 CG2 ILE A 51 9.083 3.629 2.707 1.00 0.00 C ATOM 812 CD1 ILE A 51 6.837 5.371 3.765 1.00 0.00 C ATOM 0 H ILE A 51 6.490 1.755 5.034 1.00 0.00 H new ATOM 0 HA ILE A 51 7.175 1.536 2.320 1.00 0.00 H new ATOM 0 HB ILE A 51 8.191 3.232 4.615 1.00 0.00 H new ATOM 0 HG12 ILE A 51 6.446 3.930 2.208 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.798 3.480 3.773 1.00 0.00 H new ATOM 0 HG21 ILE A 51 9.253 4.685 2.917 1.00 0.00 H new ATOM 0 HG22 ILE A 51 9.984 3.062 2.941 1.00 0.00 H new ATOM 0 HG23 ILE A 51 8.840 3.504 1.652 1.00 0.00 H new ATOM 0 HD11 ILE A 51 5.933 5.943 3.555 1.00 0.00 H new ATOM 0 HD12 ILE A 51 7.024 5.370 4.839 1.00 0.00 H new ATOM 0 HD13 ILE A 51 7.683 5.826 3.249 1.00 0.00 H new ATOM 824 N ASP A 52 9.650 0.871 4.450 1.00 0.00 N ATOM 825 CA ASP A 52 10.934 0.193 4.564 1.00 0.00 C ATOM 826 C ASP A 52 10.796 -1.318 4.376 1.00 0.00 C ATOM 827 O ASP A 52 11.707 -1.971 3.869 1.00 0.00 O ATOM 828 CB ASP A 52 11.536 0.520 5.922 1.00 0.00 C ATOM 829 CG ASP A 52 12.963 -0.007 6.048 1.00 0.00 C ATOM 830 OD1 ASP A 52 13.813 0.422 5.237 1.00 0.00 O ATOM 831 OD2 ASP A 52 13.194 -0.836 6.958 1.00 0.00 O ATOM 0 H ASP A 52 9.337 1.335 5.303 1.00 0.00 H new ATOM 0 HA ASP A 52 11.594 0.546 3.772 1.00 0.00 H new ATOM 0 HB2 ASP A 52 11.532 1.600 6.071 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.917 0.087 6.708 1.00 0.00 H new ATOM 836 N TYR A 53 9.658 -1.885 4.782 1.00 0.00 N ATOM 837 CA TYR A 53 9.419 -3.307 4.626 1.00 0.00 C ATOM 838 C TYR A 53 9.324 -3.665 3.146 1.00 0.00 C ATOM 839 O TYR A 53 9.745 -4.751 2.752 1.00 0.00 O ATOM 840 CB TYR A 53 8.190 -3.731 5.414 1.00 0.00 C ATOM 841 CG TYR A 53 8.578 -4.297 6.766 1.00 0.00 C ATOM 842 CD1 TYR A 53 9.034 -3.452 7.789 1.00 0.00 C ATOM 843 CD2 TYR A 53 8.492 -5.680 6.990 1.00 0.00 C ATOM 844 CE1 TYR A 53 9.384 -3.984 9.038 1.00 0.00 C ATOM 845 CE2 TYR A 53 8.830 -6.216 8.241 1.00 0.00 C ATOM 846 CZ TYR A 53 9.277 -5.369 9.273 1.00 0.00 C ATOM 847 OH TYR A 53 9.606 -5.887 10.491 1.00 0.00 O ATOM 0 H TYR A 53 8.892 -1.374 5.221 1.00 0.00 H new ATOM 0 HA TYR A 53 10.261 -3.864 5.037 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.529 -2.875 5.551 1.00 0.00 H new ATOM 0 HB3 TYR A 53 7.632 -4.478 4.850 1.00 0.00 H new ATOM 0 HD1 TYR A 53 9.116 -2.389 7.614 1.00 0.00 H new ATOM 0 HD2 TYR A 53 8.164 -6.334 6.196 1.00 0.00 H new ATOM 0 HE1 TYR A 53 9.737 -3.330 9.822 1.00 0.00 H new ATOM 0 HE2 TYR A 53 8.747 -7.279 8.413 1.00 0.00 H new ATOM 0 HH TYR A 53 9.433 -5.220 11.188 1.00 0.00 H new ATOM 857 N SER A 54 8.778 -2.764 2.323 1.00 0.00 N ATOM 858 CA SER A 54 8.774 -2.947 0.876 1.00 0.00 C ATOM 859 C SER A 54 10.196 -2.826 0.337 1.00 0.00 C ATOM 860 O SER A 54 10.640 -3.650 -0.462 1.00 0.00 O ATOM 861 CB SER A 54 7.877 -1.886 0.235 1.00 0.00 C ATOM 862 OG SER A 54 7.772 -2.121 -1.151 1.00 0.00 O ATOM 0 H SER A 54 8.334 -1.902 2.639 1.00 0.00 H new ATOM 0 HA SER A 54 8.389 -3.938 0.634 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.888 -1.909 0.693 1.00 0.00 H new ATOM 0 HB3 SER A 54 8.288 -0.893 0.414 1.00 0.00 H new ATOM 0 HG SER A 54 7.195 -1.440 -1.556 1.00 0.00 H new ATOM 868 N ARG A 55 10.906 -1.786 0.784 1.00 0.00 N ATOM 869 CA ARG A 55 12.258 -1.451 0.354 1.00 0.00 C ATOM 870 C ARG A 55 13.240 -2.606 0.556 1.00 0.00 C ATOM 871 O ARG A 55 14.117 -2.812 -0.281 1.00 0.00 O ATOM 872 CB ARG A 55 12.677 -0.209 1.151 1.00 0.00 C ATOM 873 CG ARG A 55 14.167 0.123 1.106 1.00 0.00 C ATOM 874 CD ARG A 55 14.663 0.362 -0.318 1.00 0.00 C ATOM 875 NE ARG A 55 14.069 1.569 -0.911 1.00 0.00 N ATOM 876 CZ ARG A 55 14.036 1.806 -2.224 1.00 0.00 C ATOM 877 NH1 ARG A 55 14.540 0.934 -3.095 1.00 0.00 N ATOM 878 NH2 ARG A 55 13.499 2.925 -2.696 1.00 0.00 N ATOM 0 H ARG A 55 10.539 -1.135 1.478 1.00 0.00 H new ATOM 0 HA ARG A 55 12.272 -1.252 -0.718 1.00 0.00 H new ATOM 0 HB2 ARG A 55 12.119 0.649 0.776 1.00 0.00 H new ATOM 0 HB3 ARG A 55 12.384 -0.349 2.191 1.00 0.00 H new ATOM 0 HG2 ARG A 55 14.358 1.011 1.709 1.00 0.00 H new ATOM 0 HG3 ARG A 55 14.733 -0.694 1.554 1.00 0.00 H new ATOM 0 HD2 ARG A 55 15.749 0.457 -0.313 1.00 0.00 H new ATOM 0 HD3 ARG A 55 14.422 -0.503 -0.936 1.00 0.00 H new ATOM 0 HE ARG A 55 13.660 2.263 -0.285 1.00 0.00 H new ATOM 0 HH11 ARG A 55 14.961 0.066 -2.763 1.00 0.00 H new ATOM 0 HH12 ARG A 55 14.505 1.134 -4.095 1.00 0.00 H new ATOM 0 HH21 ARG A 55 13.107 3.613 -2.053 1.00 0.00 H new ATOM 0 HH22 ARG A 55 13.479 3.096 -3.701 1.00 0.00 H new ATOM 892 N LEU A 56 13.103 -3.357 1.650 1.00 0.00 N ATOM 893 CA LEU A 56 14.026 -4.440 1.976 1.00 0.00 C ATOM 894 C LEU A 56 13.806 -5.738 1.193 1.00 0.00 C ATOM 895 O LEU A 56 14.684 -6.600 1.209 1.00 0.00 O ATOM 896 CB LEU A 56 13.906 -4.748 3.469 1.00 0.00 C ATOM 897 CG LEU A 56 14.529 -3.665 4.356 1.00 0.00 C ATOM 898 CD1 LEU A 56 14.265 -4.028 5.815 1.00 0.00 C ATOM 899 CD2 LEU A 56 16.039 -3.566 4.134 1.00 0.00 C ATOM 0 H LEU A 56 12.353 -3.231 2.330 1.00 0.00 H new ATOM 0 HA LEU A 56 15.017 -4.084 1.695 1.00 0.00 H new ATOM 0 HB2 LEU A 56 12.853 -4.860 3.728 1.00 0.00 H new ATOM 0 HB3 LEU A 56 14.389 -5.703 3.677 1.00 0.00 H new ATOM 0 HG LEU A 56 14.083 -2.703 4.103 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.701 -3.268 6.464 1.00 0.00 H new ATOM 0 HD12 LEU A 56 13.190 -4.079 5.988 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.715 -4.996 6.036 1.00 0.00 H new ATOM 0 HD21 LEU A 56 16.451 -2.789 4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 56 16.505 -4.521 4.374 1.00 0.00 H new ATOM 0 HD23 LEU A 56 16.238 -3.317 3.092 1.00 0.00 H new ATOM 911 N CYS A 57 12.666 -5.896 0.519 1.00 0.00 N ATOM 912 CA CYS A 57 12.280 -7.181 -0.058 1.00 0.00 C ATOM 913 C CYS A 57 12.205 -7.189 -1.594 1.00 0.00 C ATOM 914 O CYS A 57 12.093 -6.131 -2.213 1.00 0.00 O ATOM 915 CB CYS A 57 10.950 -7.571 0.585 1.00 0.00 C ATOM 916 SG CYS A 57 11.168 -7.685 2.379 1.00 0.00 S ATOM 0 H CYS A 57 11.993 -5.146 0.360 1.00 0.00 H new ATOM 0 HA CYS A 57 13.056 -7.915 0.159 1.00 0.00 H new ATOM 0 HB2 CYS A 57 10.186 -6.832 0.346 1.00 0.00 H new ATOM 0 HB3 CYS A 57 10.606 -8.526 0.187 1.00 0.00 H new ATOM 0 HG CYS A 57 10.690 -6.616 2.943 1.00 0.00 H new ATOM 922 N PRO A 58 12.265 -8.383 -2.217 1.00 0.00 N ATOM 923 CA PRO A 58 12.225 -8.585 -3.667 1.00 0.00 C ATOM 924 C PRO A 58 10.845 -8.304 -4.274 1.00 0.00 C ATOM 925 O PRO A 58 9.906 -7.951 -3.561 1.00 0.00 O ATOM 926 CB PRO A 58 12.634 -10.047 -3.874 1.00 0.00 C ATOM 927 CG PRO A 58 12.119 -10.720 -2.605 1.00 0.00 C ATOM 928 CD PRO A 58 12.393 -9.664 -1.542 1.00 0.00 C ATOM 0 HA PRO A 58 12.892 -7.887 -4.173 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.181 -10.471 -4.770 1.00 0.00 H new ATOM 0 HB3 PRO A 58 13.713 -10.155 -3.980 1.00 0.00 H new ATOM 0 HG2 PRO A 58 11.058 -10.961 -2.675 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.645 -11.652 -2.397 1.00 0.00 H new ATOM 0 HD2 PRO A 58 11.684 -9.745 -0.718 1.00 0.00 H new ATOM 0 HD3 PRO A 58 13.390 -9.785 -1.118 1.00 0.00 H new ATOM 936 N ASP A 59 10.731 -8.463 -5.597 1.00 0.00 N ATOM 937 CA ASP A 59 9.561 -8.070 -6.383 1.00 0.00 C ATOM 938 C ASP A 59 8.244 -8.677 -5.906 1.00 0.00 C ATOM 939 O ASP A 59 7.210 -8.018 -6.000 1.00 0.00 O ATOM 940 CB ASP A 59 9.775 -8.443 -7.851 1.00 0.00 C ATOM 941 CG ASP A 59 10.189 -9.906 -8.016 1.00 0.00 C ATOM 942 OD1 ASP A 59 11.387 -10.190 -7.799 1.00 0.00 O ATOM 943 OD2 ASP A 59 9.306 -10.723 -8.355 1.00 0.00 O ATOM 0 H ASP A 59 11.470 -8.879 -6.163 1.00 0.00 H new ATOM 0 HA ASP A 59 9.470 -6.992 -6.253 1.00 0.00 H new ATOM 0 HB2 ASP A 59 8.856 -8.261 -8.409 1.00 0.00 H new ATOM 0 HB3 ASP A 59 10.542 -7.799 -8.281 1.00 0.00 H new ATOM 948 N SER A 60 8.249 -9.913 -5.398 1.00 0.00 N ATOM 949 CA SER A 60 7.010 -10.507 -4.918 1.00 0.00 C ATOM 950 C SER A 60 6.487 -9.703 -3.736 1.00 0.00 C ATOM 951 O SER A 60 5.279 -9.546 -3.557 1.00 0.00 O ATOM 952 CB SER A 60 7.253 -11.952 -4.502 1.00 0.00 C ATOM 953 OG SER A 60 6.025 -12.561 -4.173 1.00 0.00 O ATOM 0 H SER A 60 9.076 -10.504 -5.312 1.00 0.00 H new ATOM 0 HA SER A 60 6.269 -10.493 -5.717 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.736 -12.498 -5.312 1.00 0.00 H new ATOM 0 HB3 SER A 60 7.928 -11.987 -3.647 1.00 0.00 H new ATOM 0 HG SER A 60 6.182 -13.491 -3.907 1.00 0.00 H new ATOM 959 N HIS A 61 7.416 -9.191 -2.923 1.00 0.00 N ATOM 960 CA HIS A 61 7.072 -8.403 -1.757 1.00 0.00 C ATOM 961 C HIS A 61 6.840 -6.950 -2.157 1.00 0.00 C ATOM 962 O HIS A 61 6.032 -6.275 -1.527 1.00 0.00 O ATOM 963 CB HIS A 61 8.187 -8.534 -0.729 1.00 0.00 C ATOM 964 CG HIS A 61 7.826 -7.977 0.622 1.00 0.00 C ATOM 965 ND1 HIS A 61 7.686 -6.625 0.935 1.00 0.00 N ATOM 966 CD2 HIS A 61 7.587 -8.723 1.738 1.00 0.00 C ATOM 967 CE1 HIS A 61 7.371 -6.593 2.239 1.00 0.00 C ATOM 968 NE2 HIS A 61 7.308 -7.835 2.749 1.00 0.00 N ATOM 0 H HIS A 61 8.419 -9.315 -3.061 1.00 0.00 H new ATOM 0 HA HIS A 61 6.146 -8.769 -1.313 1.00 0.00 H new ATOM 0 HB2 HIS A 61 8.449 -9.586 -0.621 1.00 0.00 H new ATOM 0 HB3 HIS A 61 9.074 -8.021 -1.100 1.00 0.00 H new ATOM 0 HD2 HIS A 61 7.612 -9.800 1.813 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.192 -5.690 2.803 1.00 0.00 H new ATOM 0 HE2 HIS A 61 7.091 -8.076 3.716 1.00 0.00 H new ATOM 976 N LYS A 62 7.530 -6.451 -3.193 1.00 0.00 N ATOM 977 CA LYS A 62 7.239 -5.118 -3.709 1.00 0.00 C ATOM 978 C LYS A 62 5.781 -5.076 -4.145 1.00 0.00 C ATOM 979 O LYS A 62 5.072 -4.123 -3.842 1.00 0.00 O ATOM 980 CB LYS A 62 8.164 -4.786 -4.888 1.00 0.00 C ATOM 981 CG LYS A 62 9.626 -4.608 -4.468 1.00 0.00 C ATOM 982 CD LYS A 62 9.793 -3.380 -3.573 1.00 0.00 C ATOM 983 CE LYS A 62 11.264 -3.141 -3.226 1.00 0.00 C ATOM 984 NZ LYS A 62 12.057 -2.768 -4.410 1.00 0.00 N ATOM 0 H LYS A 62 8.279 -6.945 -3.678 1.00 0.00 H new ATOM 0 HA LYS A 62 7.412 -4.374 -2.931 1.00 0.00 H new ATOM 0 HB2 LYS A 62 8.099 -5.582 -5.630 1.00 0.00 H new ATOM 0 HB3 LYS A 62 7.816 -3.872 -5.370 1.00 0.00 H new ATOM 0 HG2 LYS A 62 9.967 -5.498 -3.938 1.00 0.00 H new ATOM 0 HG3 LYS A 62 10.253 -4.505 -5.354 1.00 0.00 H new ATOM 0 HD2 LYS A 62 9.389 -2.502 -4.077 1.00 0.00 H new ATOM 0 HD3 LYS A 62 9.218 -3.514 -2.657 1.00 0.00 H new ATOM 0 HE2 LYS A 62 11.336 -2.352 -2.478 1.00 0.00 H new ATOM 0 HE3 LYS A 62 11.682 -4.043 -2.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 12.989 -2.420 -4.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 12.180 -3.600 -5.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 11.563 -2.020 -4.937 1.00 0.00 H new ATOM 998 N LEU A 63 5.332 -6.114 -4.857 1.00 0.00 N ATOM 999 CA LEU A 63 3.963 -6.209 -5.329 1.00 0.00 C ATOM 1000 C LEU A 63 2.986 -6.366 -4.163 1.00 0.00 C ATOM 1001 O LEU A 63 2.016 -5.616 -4.059 1.00 0.00 O ATOM 1002 CB LEU A 63 3.875 -7.399 -6.289 1.00 0.00 C ATOM 1003 CG LEU A 63 2.483 -7.559 -6.898 1.00 0.00 C ATOM 1004 CD1 LEU A 63 2.130 -6.372 -7.790 1.00 0.00 C ATOM 1005 CD2 LEU A 63 2.466 -8.832 -7.740 1.00 0.00 C ATOM 0 H LEU A 63 5.915 -6.909 -5.118 1.00 0.00 H new ATOM 0 HA LEU A 63 3.685 -5.292 -5.848 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.605 -7.271 -7.088 1.00 0.00 H new ATOM 0 HB3 LEU A 63 4.142 -8.312 -5.756 1.00 0.00 H new ATOM 0 HG LEU A 63 1.752 -7.612 -6.091 1.00 0.00 H new ATOM 0 HD11 LEU A 63 1.134 -6.515 -8.209 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.147 -5.456 -7.200 1.00 0.00 H new ATOM 0 HD13 LEU A 63 2.856 -6.296 -8.599 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.479 -8.962 -8.183 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.211 -8.755 -8.532 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.696 -9.690 -7.108 1.00 0.00 H new ATOM 1017 N GLY A 64 3.238 -7.338 -3.282 1.00 0.00 N ATOM 1018 CA GLY A 64 2.363 -7.585 -2.148 1.00 0.00 C ATOM 1019 C GLY A 64 2.300 -6.376 -1.218 1.00 0.00 C ATOM 1020 O GLY A 64 1.234 -6.042 -0.702 1.00 0.00 O ATOM 0 H GLY A 64 4.042 -7.963 -3.338 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.361 -7.824 -2.505 1.00 0.00 H new ATOM 0 HA3 GLY A 64 2.719 -8.454 -1.594 1.00 0.00 H new ATOM 1024 N SER A 65 3.435 -5.713 -0.999 1.00 0.00 N ATOM 1025 CA SER A 65 3.483 -4.546 -0.139 1.00 0.00 C ATOM 1026 C SER A 65 2.775 -3.377 -0.806 1.00 0.00 C ATOM 1027 O SER A 65 2.170 -2.565 -0.116 1.00 0.00 O ATOM 1028 CB SER A 65 4.922 -4.200 0.229 1.00 0.00 C ATOM 1029 OG SER A 65 4.898 -3.221 1.244 1.00 0.00 O ATOM 0 H SER A 65 4.333 -5.970 -1.410 1.00 0.00 H new ATOM 0 HA SER A 65 2.960 -4.771 0.790 1.00 0.00 H new ATOM 0 HB2 SER A 65 5.450 -5.090 0.572 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.458 -3.828 -0.644 1.00 0.00 H new ATOM 0 HG SER A 65 5.596 -3.416 1.903 1.00 0.00 H new ATOM 1035 N LEU A 66 2.834 -3.268 -2.136 1.00 0.00 N ATOM 1036 CA LEU A 66 2.046 -2.253 -2.816 1.00 0.00 C ATOM 1037 C LEU A 66 0.554 -2.529 -2.643 1.00 0.00 C ATOM 1038 O LEU A 66 -0.218 -1.578 -2.564 1.00 0.00 O ATOM 1039 CB LEU A 66 2.436 -2.172 -4.295 1.00 0.00 C ATOM 1040 CG LEU A 66 3.761 -1.426 -4.487 1.00 0.00 C ATOM 1041 CD1 LEU A 66 4.165 -1.526 -5.960 1.00 0.00 C ATOM 1042 CD2 LEU A 66 3.625 0.046 -4.101 1.00 0.00 C ATOM 0 H LEU A 66 3.405 -3.855 -2.744 1.00 0.00 H new ATOM 0 HA LEU A 66 2.258 -1.284 -2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.521 -3.178 -4.705 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.648 -1.666 -4.853 1.00 0.00 H new ATOM 0 HG LEU A 66 4.518 -1.878 -3.846 1.00 0.00 H new ATOM 0 HD11 LEU A 66 5.107 -1.000 -6.115 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.285 -2.574 -6.234 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.391 -1.075 -6.581 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.580 0.550 -4.247 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.866 0.517 -4.726 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.331 0.122 -3.054 1.00 0.00 H new ATOM 1054 N TYR A 67 0.124 -3.796 -2.581 1.00 0.00 N ATOM 1055 CA TYR A 67 -1.277 -4.086 -2.296 1.00 0.00 C ATOM 1056 C TYR A 67 -1.614 -3.651 -0.865 1.00 0.00 C ATOM 1057 O TYR A 67 -2.696 -3.124 -0.620 1.00 0.00 O ATOM 1058 CB TYR A 67 -1.585 -5.575 -2.501 1.00 0.00 C ATOM 1059 CG TYR A 67 -1.797 -6.007 -3.942 1.00 0.00 C ATOM 1060 CD1 TYR A 67 -1.010 -5.477 -4.979 1.00 0.00 C ATOM 1061 CD2 TYR A 67 -2.796 -6.951 -4.245 1.00 0.00 C ATOM 1062 CE1 TYR A 67 -1.223 -5.872 -6.307 1.00 0.00 C ATOM 1063 CE2 TYR A 67 -3.014 -7.349 -5.572 1.00 0.00 C ATOM 1064 CZ TYR A 67 -2.230 -6.808 -6.609 1.00 0.00 C ATOM 1065 OH TYR A 67 -2.444 -7.186 -7.898 1.00 0.00 O ATOM 0 H TYR A 67 0.714 -4.616 -2.721 1.00 0.00 H new ATOM 0 HA TYR A 67 -1.899 -3.524 -2.992 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.765 -6.159 -2.082 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -2.479 -5.825 -1.930 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -0.235 -4.760 -4.751 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -3.397 -7.371 -3.452 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.615 -5.458 -7.098 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.784 -8.071 -5.799 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.817 -6.715 -8.485 1.00 0.00 H new ATOM 1075 N ILE A 68 -0.694 -3.865 0.085 1.00 0.00 N ATOM 1076 CA ILE A 68 -0.874 -3.415 1.464 1.00 0.00 C ATOM 1077 C ILE A 68 -0.936 -1.887 1.542 1.00 0.00 C ATOM 1078 O ILE A 68 -1.851 -1.332 2.151 1.00 0.00 O ATOM 1079 CB ILE A 68 0.267 -3.969 2.331 1.00 0.00 C ATOM 1080 CG1 ILE A 68 0.111 -5.489 2.432 1.00 0.00 C ATOM 1081 CG2 ILE A 68 0.236 -3.348 3.731 1.00 0.00 C ATOM 1082 CD1 ILE A 68 1.376 -6.175 2.951 1.00 0.00 C ATOM 0 H ILE A 68 0.187 -4.351 -0.082 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.824 -3.794 1.842 1.00 0.00 H new ATOM 0 HB ILE A 68 1.223 -3.718 1.872 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.723 -5.722 3.094 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.140 -5.891 1.450 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.053 -3.755 4.328 1.00 0.00 H new ATOM 0 HG22 ILE A 68 0.348 -2.267 3.652 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -0.715 -3.580 4.211 1.00 0.00 H new ATOM 0 HD11 ILE A 68 1.211 -7.251 3.003 1.00 0.00 H new ATOM 0 HD12 ILE A 68 2.206 -5.967 2.275 1.00 0.00 H new ATOM 0 HD13 ILE A 68 1.614 -5.796 3.945 1.00 0.00 H new ATOM 1094 N ILE A 69 0.037 -1.208 0.927 1.00 0.00 N ATOM 1095 CA ILE A 69 0.124 0.247 0.913 1.00 0.00 C ATOM 1096 C ILE A 69 -1.100 0.828 0.213 1.00 0.00 C ATOM 1097 O ILE A 69 -1.587 1.893 0.593 1.00 0.00 O ATOM 1098 CB ILE A 69 1.417 0.649 0.188 1.00 0.00 C ATOM 1099 CG1 ILE A 69 2.638 0.246 1.023 1.00 0.00 C ATOM 1100 CG2 ILE A 69 1.461 2.159 -0.062 1.00 0.00 C ATOM 1101 CD1 ILE A 69 3.899 0.159 0.161 1.00 0.00 C ATOM 0 H ILE A 69 0.795 -1.664 0.419 1.00 0.00 H new ATOM 0 HA ILE A 69 0.147 0.639 1.930 1.00 0.00 H new ATOM 0 HB ILE A 69 1.436 0.131 -0.771 1.00 0.00 H new ATOM 0 HG12 ILE A 69 2.791 0.972 1.821 1.00 0.00 H new ATOM 0 HG13 ILE A 69 2.454 -0.717 1.499 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.387 2.416 -0.576 1.00 0.00 H new ATOM 0 HG22 ILE A 69 0.611 2.451 -0.678 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.417 2.687 0.891 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.746 -0.129 0.784 1.00 0.00 H new ATOM 0 HD12 ILE A 69 3.754 -0.586 -0.622 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.096 1.130 -0.294 1.00 0.00 H new ATOM 1113 N ASP A 70 -1.596 0.131 -0.810 1.00 0.00 N ATOM 1114 CA ASP A 70 -2.786 0.534 -1.534 1.00 0.00 C ATOM 1115 C ASP A 70 -4.016 0.417 -0.643 1.00 0.00 C ATOM 1116 O ASP A 70 -4.854 1.318 -0.662 1.00 0.00 O ATOM 1117 CB ASP A 70 -2.895 -0.332 -2.791 1.00 0.00 C ATOM 1118 CG ASP A 70 -4.069 0.063 -3.678 1.00 0.00 C ATOM 1119 OD1 ASP A 70 -4.017 1.183 -4.229 1.00 0.00 O ATOM 1120 OD2 ASP A 70 -5.001 -0.761 -3.792 1.00 0.00 O ATOM 0 H ASP A 70 -1.176 -0.732 -1.156 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.720 1.580 -1.833 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -1.970 -0.253 -3.363 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -3.001 -1.377 -2.499 1.00 0.00 H new ATOM 1125 N SER A 71 -4.152 -0.659 0.137 1.00 0.00 N ATOM 1126 CA SER A 71 -5.327 -0.777 0.987 1.00 0.00 C ATOM 1127 C SER A 71 -5.328 0.282 2.081 1.00 0.00 C ATOM 1128 O SER A 71 -6.322 0.982 2.261 1.00 0.00 O ATOM 1129 CB SER A 71 -5.439 -2.179 1.581 1.00 0.00 C ATOM 1130 OG SER A 71 -6.749 -2.332 2.086 1.00 0.00 O ATOM 0 H SER A 71 -3.488 -1.431 0.195 1.00 0.00 H new ATOM 0 HA SER A 71 -6.204 -0.608 0.362 1.00 0.00 H new ATOM 0 HB2 SER A 71 -5.232 -2.933 0.821 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.705 -2.317 2.375 1.00 0.00 H new ATOM 0 HG SER A 71 -7.384 -2.377 1.341 1.00 0.00 H new ATOM 1136 N ILE A 72 -4.219 0.412 2.819 1.00 0.00 N ATOM 1137 CA ILE A 72 -4.134 1.391 3.892 1.00 0.00 C ATOM 1138 C ILE A 72 -4.217 2.807 3.319 1.00 0.00 C ATOM 1139 O ILE A 72 -4.798 3.691 3.939 1.00 0.00 O ATOM 1140 CB ILE A 72 -2.852 1.164 4.707 1.00 0.00 C ATOM 1141 CG1 ILE A 72 -2.872 -0.262 5.279 1.00 0.00 C ATOM 1142 CG2 ILE A 72 -2.760 2.182 5.846 1.00 0.00 C ATOM 1143 CD1 ILE A 72 -1.668 -0.552 6.178 1.00 0.00 C ATOM 0 H ILE A 72 -3.377 -0.148 2.689 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.978 1.268 4.571 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.983 1.291 4.061 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -3.790 -0.408 5.849 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.889 -0.979 4.458 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.847 2.009 6.415 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.745 3.190 5.432 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.623 2.072 6.503 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.733 -1.573 6.555 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.749 -0.435 5.604 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.664 0.145 7.016 1.00 0.00 H new ATOM 1155 N GLY A 73 -3.641 3.030 2.134 1.00 0.00 N ATOM 1156 CA GLY A 73 -3.656 4.334 1.491 1.00 0.00 C ATOM 1157 C GLY A 73 -5.067 4.755 1.086 1.00 0.00 C ATOM 1158 O GLY A 73 -5.520 5.834 1.465 1.00 0.00 O ATOM 0 H GLY A 73 -3.154 2.310 1.600 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.236 5.077 2.169 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -3.017 4.310 0.608 1.00 0.00 H new ATOM 1162 N ARG A 74 -5.763 3.909 0.321 1.00 0.00 N ATOM 1163 CA ARG A 74 -7.127 4.184 -0.124 1.00 0.00 C ATOM 1164 C ARG A 74 -8.071 4.315 1.069 1.00 0.00 C ATOM 1165 O ARG A 74 -8.976 5.145 1.050 1.00 0.00 O ATOM 1166 CB ARG A 74 -7.570 3.051 -1.057 1.00 0.00 C ATOM 1167 CG ARG A 74 -7.185 3.352 -2.509 1.00 0.00 C ATOM 1168 CD ARG A 74 -6.690 2.095 -3.223 1.00 0.00 C ATOM 1169 NE ARG A 74 -7.726 1.092 -3.500 1.00 0.00 N ATOM 1170 CZ ARG A 74 -7.816 -0.041 -2.802 1.00 0.00 C ATOM 1171 NH1 ARG A 74 -7.069 -0.235 -1.726 1.00 0.00 N ATOM 1172 NH2 ARG A 74 -8.659 -0.995 -3.175 1.00 0.00 N ATOM 0 H ARG A 74 -5.395 3.016 -0.006 1.00 0.00 H new ATOM 0 HA ARG A 74 -7.157 5.132 -0.662 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -7.110 2.115 -0.742 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -8.649 2.916 -0.984 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -8.046 3.759 -3.039 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -6.407 4.115 -2.531 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -6.228 2.389 -4.166 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -5.911 1.633 -2.616 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.397 1.267 -4.248 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -6.415 0.487 -1.422 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -7.147 -1.106 -1.201 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.244 -0.865 -4.001 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -8.722 -1.859 -2.636 1.00 0.00 H new ATOM 1186 N ALA A 75 -7.867 3.499 2.109 1.00 0.00 N ATOM 1187 CA ALA A 75 -8.701 3.547 3.296 1.00 0.00 C ATOM 1188 C ALA A 75 -8.467 4.839 4.078 1.00 0.00 C ATOM 1189 O ALA A 75 -9.424 5.474 4.518 1.00 0.00 O ATOM 1190 CB ALA A 75 -8.406 2.321 4.157 1.00 0.00 C ATOM 0 H ALA A 75 -7.127 2.798 2.144 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.751 3.536 3.002 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -9.028 2.347 5.052 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.625 1.417 3.589 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.355 2.323 4.445 1.00 0.00 H new ATOM 1196 N TYR A 76 -7.202 5.236 4.257 1.00 0.00 N ATOM 1197 CA TYR A 76 -6.872 6.484 4.930 1.00 0.00 C ATOM 1198 C TYR A 76 -7.446 7.657 4.153 1.00 0.00 C ATOM 1199 O TYR A 76 -8.038 8.554 4.749 1.00 0.00 O ATOM 1200 CB TYR A 76 -5.353 6.650 5.024 1.00 0.00 C ATOM 1201 CG TYR A 76 -4.656 5.858 6.110 1.00 0.00 C ATOM 1202 CD1 TYR A 76 -5.309 4.824 6.800 1.00 0.00 C ATOM 1203 CD2 TYR A 76 -3.325 6.172 6.427 1.00 0.00 C ATOM 1204 CE1 TYR A 76 -4.645 4.123 7.817 1.00 0.00 C ATOM 1205 CE2 TYR A 76 -2.659 5.482 7.447 1.00 0.00 C ATOM 1206 CZ TYR A 76 -3.321 4.463 8.153 1.00 0.00 C ATOM 1207 OH TYR A 76 -2.676 3.811 9.161 1.00 0.00 O ATOM 0 H TYR A 76 -6.391 4.704 3.941 1.00 0.00 H new ATOM 0 HA TYR A 76 -7.298 6.459 5.933 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -4.919 6.370 4.064 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -5.133 7.707 5.177 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -6.327 4.567 6.546 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -2.812 6.950 5.881 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -5.148 3.324 8.341 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.637 5.733 7.691 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.770 4.172 9.257 1.00 0.00 H new ATOM 1217 N LEU A 77 -7.269 7.648 2.828 1.00 0.00 N ATOM 1218 CA LEU A 77 -7.712 8.733 1.974 1.00 0.00 C ATOM 1219 C LEU A 77 -9.215 8.920 2.127 1.00 0.00 C ATOM 1220 O LEU A 77 -9.670 10.030 2.398 1.00 0.00 O ATOM 1221 CB LEU A 77 -7.281 8.414 0.537 1.00 0.00 C ATOM 1222 CG LEU A 77 -7.345 9.604 -0.425 1.00 0.00 C ATOM 1223 CD1 LEU A 77 -6.656 9.207 -1.731 1.00 0.00 C ATOM 1224 CD2 LEU A 77 -8.780 10.018 -0.748 1.00 0.00 C ATOM 0 H LEU A 77 -6.814 6.885 2.326 1.00 0.00 H new ATOM 0 HA LEU A 77 -7.256 9.682 2.256 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.261 8.031 0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.914 7.616 0.150 1.00 0.00 H new ATOM 0 HG LEU A 77 -6.852 10.448 0.057 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.691 10.043 -2.430 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -5.617 8.946 -1.530 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.168 8.348 -2.166 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -8.769 10.865 -1.433 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.304 9.183 -1.212 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -9.292 10.302 0.171 1.00 0.00 H new ATOM 1236 N ASP A 78 -9.991 7.846 1.957 1.00 0.00 N ATOM 1237 CA ASP A 78 -11.437 7.933 2.093 1.00 0.00 C ATOM 1238 C ASP A 78 -11.815 8.443 3.481 1.00 0.00 C ATOM 1239 O ASP A 78 -12.678 9.311 3.607 1.00 0.00 O ATOM 1240 CB ASP A 78 -12.048 6.552 1.868 1.00 0.00 C ATOM 1241 CG ASP A 78 -13.575 6.613 1.872 1.00 0.00 C ATOM 1242 OD1 ASP A 78 -14.139 7.081 0.859 1.00 0.00 O ATOM 1243 OD2 ASP A 78 -14.166 6.190 2.892 1.00 0.00 O ATOM 0 H ASP A 78 -9.641 6.916 1.727 1.00 0.00 H new ATOM 0 HA ASP A 78 -11.821 8.633 1.351 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -11.701 6.149 0.917 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -11.707 5.870 2.647 1.00 0.00 H new ATOM 1248 N GLU A 79 -11.169 7.905 4.522 1.00 0.00 N ATOM 1249 CA GLU A 79 -11.518 8.228 5.892 1.00 0.00 C ATOM 1250 C GLU A 79 -11.282 9.705 6.214 1.00 0.00 C ATOM 1251 O GLU A 79 -12.119 10.329 6.862 1.00 0.00 O ATOM 1252 CB GLU A 79 -10.710 7.327 6.831 1.00 0.00 C ATOM 1253 CG GLU A 79 -11.104 7.529 8.295 1.00 0.00 C ATOM 1254 CD GLU A 79 -12.576 7.188 8.546 1.00 0.00 C ATOM 1255 OE1 GLU A 79 -12.949 6.024 8.279 1.00 0.00 O ATOM 1256 OE2 GLU A 79 -13.317 8.089 8.999 1.00 0.00 O ATOM 0 H GLU A 79 -10.399 7.242 4.431 1.00 0.00 H new ATOM 0 HA GLU A 79 -12.584 8.050 6.032 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.864 6.284 6.554 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -9.647 7.536 6.709 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.474 6.905 8.929 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.918 8.564 8.581 1.00 0.00 H new ATOM 1263 N THR A 80 -10.155 10.275 5.773 1.00 0.00 N ATOM 1264 CA THR A 80 -9.832 11.654 6.103 1.00 0.00 C ATOM 1265 C THR A 80 -10.537 12.650 5.183 1.00 0.00 C ATOM 1266 O THR A 80 -10.777 13.787 5.587 1.00 0.00 O ATOM 1267 CB THR A 80 -8.314 11.846 6.147 1.00 0.00 C ATOM 1268 OG1 THR A 80 -8.021 13.121 6.672 1.00 0.00 O ATOM 1269 CG2 THR A 80 -7.654 11.728 4.776 1.00 0.00 C ATOM 0 H THR A 80 -9.462 9.802 5.193 1.00 0.00 H new ATOM 0 HA THR A 80 -10.216 11.867 7.100 1.00 0.00 H new ATOM 0 HB THR A 80 -7.915 11.050 6.776 1.00 0.00 H new ATOM 0 HG1 THR A 80 -7.188 13.454 6.277 1.00 0.00 H new ATOM 0 HG21 THR A 80 -6.578 11.874 4.876 1.00 0.00 H new ATOM 0 HG22 THR A 80 -7.849 10.739 4.362 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.063 12.487 4.109 1.00 0.00 H new ATOM 1277 N ARG A 81 -10.880 12.255 3.950 1.00 0.00 N ATOM 1278 CA ARG A 81 -11.648 13.124 3.062 1.00 0.00 C ATOM 1279 C ARG A 81 -13.100 13.201 3.526 1.00 0.00 C ATOM 1280 O ARG A 81 -13.734 14.240 3.365 1.00 0.00 O ATOM 1281 CB ARG A 81 -11.559 12.620 1.615 1.00 0.00 C ATOM 1282 CG ARG A 81 -10.420 13.285 0.835 1.00 0.00 C ATOM 1283 CD ARG A 81 -9.067 13.176 1.536 1.00 0.00 C ATOM 1284 NE ARG A 81 -8.003 13.755 0.705 1.00 0.00 N ATOM 1285 CZ ARG A 81 -6.788 14.083 1.157 1.00 0.00 C ATOM 1286 NH1 ARG A 81 -6.462 13.901 2.434 1.00 0.00 N ATOM 1287 NH2 ARG A 81 -5.887 14.599 0.324 1.00 0.00 N ATOM 0 H ARG A 81 -10.639 11.348 3.552 1.00 0.00 H new ATOM 0 HA ARG A 81 -11.225 14.128 3.097 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -11.412 11.540 1.618 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -12.504 12.812 1.107 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -10.349 12.828 -0.152 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.659 14.337 0.682 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -9.107 13.691 2.496 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -8.843 12.130 1.745 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.204 13.918 -0.282 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -7.143 13.506 3.083 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -5.531 14.156 2.764 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -6.124 14.744 -0.658 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -4.960 14.850 0.667 1.00 0.00 H new ATOM 1441 N THR A 93 -1.951 12.200 12.011 1.00 0.00 N ATOM 1442 CA THR A 93 -2.674 10.945 11.827 1.00 0.00 C ATOM 1443 C THR A 93 -2.631 10.440 10.382 1.00 0.00 C ATOM 1444 O THR A 93 -1.685 10.741 9.657 1.00 0.00 O ATOM 1445 CB THR A 93 -4.088 11.048 12.414 1.00 0.00 C ATOM 1446 OG1 THR A 93 -4.395 12.351 12.866 1.00 0.00 O ATOM 1447 CG2 THR A 93 -4.146 10.096 13.607 1.00 0.00 C ATOM 0 HA THR A 93 -2.157 10.170 12.392 1.00 0.00 H new ATOM 0 HB THR A 93 -4.809 10.797 11.636 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.610 12.927 12.760 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.138 10.137 14.057 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.941 9.079 13.271 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.400 10.392 14.345 1.00 0.00 H new ATOM 1455 N CYS A 94 -3.638 9.675 9.945 1.00 0.00 N ATOM 1456 CA CYS A 94 -3.682 9.084 8.611 1.00 0.00 C ATOM 1457 C CYS A 94 -3.434 10.095 7.487 1.00 0.00 C ATOM 1458 O CYS A 94 -2.950 9.725 6.418 1.00 0.00 O ATOM 1459 CB CYS A 94 -5.045 8.417 8.433 1.00 0.00 C ATOM 1460 SG CYS A 94 -6.362 9.630 8.712 1.00 0.00 S ATOM 0 H CYS A 94 -4.452 9.449 10.517 1.00 0.00 H new ATOM 0 HA CYS A 94 -2.873 8.358 8.537 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -5.128 8.001 7.429 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -5.148 7.587 9.132 1.00 0.00 H new ATOM 0 HG CYS A 94 -7.519 9.058 8.557 1.00 0.00 H new ATOM 1466 N ALA A 95 -3.750 11.374 7.698 1.00 0.00 N ATOM 1467 CA ALA A 95 -3.477 12.393 6.700 1.00 0.00 C ATOM 1468 C ALA A 95 -1.967 12.601 6.559 1.00 0.00 C ATOM 1469 O ALA A 95 -1.454 12.791 5.453 1.00 0.00 O ATOM 1470 CB ALA A 95 -4.158 13.680 7.142 1.00 0.00 C ATOM 0 H ALA A 95 -4.193 11.721 8.549 1.00 0.00 H new ATOM 0 HA ALA A 95 -3.862 12.086 5.728 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -3.968 14.463 6.408 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.232 13.513 7.225 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.763 13.987 8.110 1.00 0.00 H new ATOM 1476 N HIS A 96 -1.252 12.565 7.685 1.00 0.00 N ATOM 1477 CA HIS A 96 0.199 12.676 7.706 1.00 0.00 C ATOM 1478 C HIS A 96 0.819 11.436 7.085 1.00 0.00 C ATOM 1479 O HIS A 96 1.858 11.506 6.432 1.00 0.00 O ATOM 1480 CB HIS A 96 0.662 12.774 9.157 1.00 0.00 C ATOM 1481 CG HIS A 96 2.088 13.235 9.293 1.00 0.00 C ATOM 1482 ND1 HIS A 96 3.182 12.408 9.557 1.00 0.00 N ATOM 1483 CD2 HIS A 96 2.515 14.526 9.180 1.00 0.00 C ATOM 1484 CE1 HIS A 96 4.247 13.225 9.588 1.00 0.00 C ATOM 1485 NE2 HIS A 96 3.878 14.500 9.366 1.00 0.00 N ATOM 0 H HIS A 96 -1.669 12.457 8.609 1.00 0.00 H new ATOM 0 HA HIS A 96 0.503 13.559 7.144 1.00 0.00 H new ATOM 0 HB2 HIS A 96 0.011 13.464 9.694 1.00 0.00 H new ATOM 0 HB3 HIS A 96 0.555 11.799 9.633 1.00 0.00 H new ATOM 0 HD2 HIS A 96 1.905 15.395 8.984 1.00 0.00 H new ATOM 0 HE1 HIS A 96 5.262 12.903 9.767 1.00 0.00 H new ATOM 0 HE2 HIS A 96 4.501 15.307 9.340 1.00 0.00 H new ATOM 1493 N ALA A 97 0.163 10.295 7.300 1.00 0.00 N ATOM 1494 CA ALA A 97 0.606 9.023 6.778 1.00 0.00 C ATOM 1495 C ALA A 97 0.576 9.036 5.254 1.00 0.00 C ATOM 1496 O ALA A 97 1.516 8.564 4.616 1.00 0.00 O ATOM 1497 CB ALA A 97 -0.317 7.957 7.347 1.00 0.00 C ATOM 0 H ALA A 97 -0.696 10.238 7.847 1.00 0.00 H new ATOM 0 HA ALA A 97 1.636 8.816 7.069 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -0.015 6.978 6.975 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -0.256 7.967 8.435 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -1.342 8.161 7.039 1.00 0.00 H new ATOM 1503 N ILE A 98 -0.495 9.574 4.659 1.00 0.00 N ATOM 1504 CA ILE A 98 -0.552 9.719 3.213 1.00 0.00 C ATOM 1505 C ILE A 98 0.514 10.714 2.762 1.00 0.00 C ATOM 1506 O ILE A 98 1.199 10.481 1.766 1.00 0.00 O ATOM 1507 CB ILE A 98 -1.945 10.193 2.784 1.00 0.00 C ATOM 1508 CG1 ILE A 98 -2.989 9.126 3.130 1.00 0.00 C ATOM 1509 CG2 ILE A 98 -1.964 10.475 1.276 1.00 0.00 C ATOM 1510 CD1 ILE A 98 -4.405 9.666 2.930 1.00 0.00 C ATOM 0 H ILE A 98 -1.320 9.910 5.155 1.00 0.00 H new ATOM 0 HA ILE A 98 -0.360 8.754 2.744 1.00 0.00 H new ATOM 0 HB ILE A 98 -2.186 11.112 3.318 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.838 8.247 2.503 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -2.860 8.806 4.164 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -2.958 10.811 0.981 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -1.234 11.250 1.042 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -1.713 9.564 0.732 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.129 8.891 3.182 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -4.559 10.530 3.576 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.538 9.962 1.889 1.00 0.00 H new ATOM 1522 N ASN A 99 0.658 11.825 3.493 1.00 0.00 N ATOM 1523 CA ASN A 99 1.657 12.830 3.157 1.00 0.00 C ATOM 1524 C ASN A 99 3.065 12.236 3.190 1.00 0.00 C ATOM 1525 O ASN A 99 3.924 12.632 2.405 1.00 0.00 O ATOM 1526 CB ASN A 99 1.527 13.990 4.152 1.00 0.00 C ATOM 1527 CG ASN A 99 2.324 15.218 3.732 1.00 0.00 C ATOM 1528 OD1 ASN A 99 2.783 15.322 2.599 1.00 0.00 O ATOM 1529 ND2 ASN A 99 2.493 16.162 4.655 1.00 0.00 N ATOM 0 H ASN A 99 0.096 12.045 4.315 1.00 0.00 H new ATOM 0 HA ASN A 99 1.488 13.193 2.143 1.00 0.00 H new ATOM 0 HB2 ASN A 99 0.476 14.261 4.252 1.00 0.00 H new ATOM 0 HB3 ASN A 99 1.866 13.660 5.134 1.00 0.00 H new ATOM 0 HD21 ASN A 99 3.019 17.007 4.430 1.00 0.00 H new ATOM 0 HD22 ASN A 99 2.097 16.041 5.587 1.00 0.00 H new ATOM 1536 N THR A 100 3.307 11.284 4.097 1.00 0.00 N ATOM 1537 CA THR A 100 4.608 10.640 4.220 1.00 0.00 C ATOM 1538 C THR A 100 4.833 9.626 3.104 1.00 0.00 C ATOM 1539 O THR A 100 5.931 9.558 2.561 1.00 0.00 O ATOM 1540 CB THR A 100 4.743 9.990 5.601 1.00 0.00 C ATOM 1541 OG1 THR A 100 4.560 10.956 6.611 1.00 0.00 O ATOM 1542 CG2 THR A 100 6.141 9.393 5.746 1.00 0.00 C ATOM 0 H THR A 100 2.609 10.944 4.759 1.00 0.00 H new ATOM 0 HA THR A 100 5.381 11.402 4.120 1.00 0.00 H new ATOM 0 HB THR A 100 3.987 9.211 5.698 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.622 11.241 6.625 1.00 0.00 H new ATOM 0 HG21 THR A 100 6.239 8.930 6.728 1.00 0.00 H new ATOM 0 HG22 THR A 100 6.297 8.641 4.973 1.00 0.00 H new ATOM 0 HG23 THR A 100 6.886 10.182 5.641 1.00 0.00 H new ATOM 1550 N LEU A 101 3.821 8.830 2.741 1.00 0.00 N ATOM 1551 CA LEU A 101 3.971 7.947 1.591 1.00 0.00 C ATOM 1552 C LEU A 101 4.213 8.796 0.339 1.00 0.00 C ATOM 1553 O LEU A 101 4.879 8.353 -0.589 1.00 0.00 O ATOM 1554 CB LEU A 101 2.715 7.097 1.388 1.00 0.00 C ATOM 1555 CG LEU A 101 2.555 5.974 2.412 1.00 0.00 C ATOM 1556 CD1 LEU A 101 1.132 5.423 2.309 1.00 0.00 C ATOM 1557 CD2 LEU A 101 3.530 4.839 2.105 1.00 0.00 C ATOM 0 H LEU A 101 2.918 8.782 3.213 1.00 0.00 H new ATOM 0 HA LEU A 101 4.815 7.281 1.768 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.839 7.744 1.433 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.739 6.663 0.388 1.00 0.00 H new ATOM 0 HG LEU A 101 2.754 6.366 3.410 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.000 4.620 3.034 1.00 0.00 H new ATOM 0 HD12 LEU A 101 0.417 6.220 2.516 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.963 5.037 1.304 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.407 4.045 2.841 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.328 4.445 1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.552 5.216 2.146 1.00 0.00 H new ATOM 1569 N GLY A 102 3.668 10.016 0.325 1.00 0.00 N ATOM 1570 CA GLY A 102 3.810 10.948 -0.783 1.00 0.00 C ATOM 1571 C GLY A 102 5.259 11.342 -1.072 1.00 0.00 C ATOM 1572 O GLY A 102 5.529 11.893 -2.137 1.00 0.00 O ATOM 0 H GLY A 102 3.110 10.383 1.096 1.00 0.00 H new ATOM 0 HA2 GLY A 102 3.378 10.502 -1.679 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.234 11.848 -0.566 1.00 0.00 H new ATOM 1576 N GLU A 103 6.193 11.072 -0.150 1.00 0.00 N ATOM 1577 CA GLU A 103 7.591 11.425 -0.363 1.00 0.00 C ATOM 1578 C GLU A 103 8.416 10.214 -0.802 1.00 0.00 C ATOM 1579 O GLU A 103 9.593 10.356 -1.136 1.00 0.00 O ATOM 1580 CB GLU A 103 8.157 12.124 0.880 1.00 0.00 C ATOM 1581 CG GLU A 103 8.787 11.159 1.885 1.00 0.00 C ATOM 1582 CD GLU A 103 9.270 11.912 3.121 1.00 0.00 C ATOM 1583 OE1 GLU A 103 8.417 12.221 3.984 1.00 0.00 O ATOM 1584 OE2 GLU A 103 10.492 12.175 3.197 1.00 0.00 O ATOM 0 H GLU A 103 6.002 10.614 0.741 1.00 0.00 H new ATOM 0 HA GLU A 103 7.654 12.136 -1.186 1.00 0.00 H new ATOM 0 HB2 GLU A 103 8.906 12.853 0.569 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.358 12.678 1.372 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.059 10.401 2.175 1.00 0.00 H new ATOM 0 HG3 GLU A 103 9.623 10.636 1.421 1.00 0.00 H new ATOM 1591 N VAL A 104 7.804 9.024 -0.804 1.00 0.00 N ATOM 1592 CA VAL A 104 8.489 7.785 -1.163 1.00 0.00 C ATOM 1593 C VAL A 104 7.801 7.038 -2.300 1.00 0.00 C ATOM 1594 O VAL A 104 8.425 6.183 -2.923 1.00 0.00 O ATOM 1595 CB VAL A 104 8.589 6.855 0.045 1.00 0.00 C ATOM 1596 CG1 VAL A 104 9.428 7.481 1.159 1.00 0.00 C ATOM 1597 CG2 VAL A 104 7.200 6.512 0.573 1.00 0.00 C ATOM 0 H VAL A 104 6.823 8.897 -0.557 1.00 0.00 H new ATOM 0 HA VAL A 104 9.483 8.076 -1.501 1.00 0.00 H new ATOM 0 HB VAL A 104 9.082 5.940 -0.283 1.00 0.00 H new ATOM 0 HG11 VAL A 104 9.480 6.795 2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 104 10.434 7.679 0.789 1.00 0.00 H new ATOM 0 HG13 VAL A 104 8.969 8.416 1.479 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.291 5.849 1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 104 6.689 7.427 0.873 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.626 6.015 -0.209 1.00 0.00 H new ATOM 1607 N ILE A 105 6.532 7.336 -2.589 1.00 0.00 N ATOM 1608 CA ILE A 105 5.793 6.631 -3.624 1.00 0.00 C ATOM 1609 C ILE A 105 6.552 6.640 -4.952 1.00 0.00 C ATOM 1610 O ILE A 105 6.438 5.698 -5.735 1.00 0.00 O ATOM 1611 CB ILE A 105 4.403 7.274 -3.738 1.00 0.00 C ATOM 1612 CG1 ILE A 105 3.436 6.396 -4.532 1.00 0.00 C ATOM 1613 CG2 ILE A 105 4.478 8.662 -4.383 1.00 0.00 C ATOM 1614 CD1 ILE A 105 3.221 5.071 -3.802 1.00 0.00 C ATOM 0 H ILE A 105 5.998 8.065 -2.115 1.00 0.00 H new ATOM 0 HA ILE A 105 5.678 5.580 -3.358 1.00 0.00 H new ATOM 0 HB ILE A 105 4.025 7.377 -2.721 1.00 0.00 H new ATOM 0 HG12 ILE A 105 2.484 6.911 -4.659 1.00 0.00 H new ATOM 0 HG13 ILE A 105 3.834 6.212 -5.530 1.00 0.00 H new ATOM 0 HG21 ILE A 105 3.477 9.088 -4.448 1.00 0.00 H new ATOM 0 HG22 ILE A 105 5.110 9.311 -3.777 1.00 0.00 H new ATOM 0 HG23 ILE A 105 4.901 8.576 -5.384 1.00 0.00 H new ATOM 0 HD11 ILE A 105 2.531 4.449 -4.372 1.00 0.00 H new ATOM 0 HD12 ILE A 105 4.175 4.554 -3.698 1.00 0.00 H new ATOM 0 HD13 ILE A 105 2.804 5.264 -2.814 1.00 0.00 H new ATOM 1626 N GLN A 106 7.325 7.701 -5.200 1.00 0.00 N ATOM 1627 CA GLN A 106 8.123 7.831 -6.408 1.00 0.00 C ATOM 1628 C GLN A 106 9.143 6.700 -6.509 1.00 0.00 C ATOM 1629 O GLN A 106 9.180 5.988 -7.513 1.00 0.00 O ATOM 1630 CB GLN A 106 8.772 9.221 -6.442 1.00 0.00 C ATOM 1631 CG GLN A 106 9.541 9.560 -5.160 1.00 0.00 C ATOM 1632 CD GLN A 106 10.049 11.001 -5.163 1.00 0.00 C ATOM 1633 OE1 GLN A 106 9.998 11.690 -6.179 1.00 0.00 O ATOM 1634 NE2 GLN A 106 10.549 11.463 -4.019 1.00 0.00 N ATOM 0 H GLN A 106 7.411 8.493 -4.563 1.00 0.00 H new ATOM 0 HA GLN A 106 7.482 7.742 -7.285 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.453 9.276 -7.292 1.00 0.00 H new ATOM 0 HB3 GLN A 106 7.999 9.972 -6.604 1.00 0.00 H new ATOM 0 HG2 GLN A 106 8.893 9.405 -4.297 1.00 0.00 H new ATOM 0 HG3 GLN A 106 10.385 8.878 -5.052 1.00 0.00 H new ATOM 0 HE21 GLN A 106 10.576 10.863 -3.195 1.00 0.00 H new ATOM 0 HE22 GLN A 106 10.905 12.417 -3.967 1.00 0.00 H new ATOM 1643 N GLU A 107 9.968 6.540 -5.470 1.00 0.00 N ATOM 1644 CA GLU A 107 11.024 5.539 -5.452 1.00 0.00 C ATOM 1645 C GLU A 107 10.470 4.134 -5.208 1.00 0.00 C ATOM 1646 O GLU A 107 11.028 3.160 -5.707 1.00 0.00 O ATOM 1647 CB GLU A 107 12.084 5.912 -4.414 1.00 0.00 C ATOM 1648 CG GLU A 107 11.503 6.016 -3.003 1.00 0.00 C ATOM 1649 CD GLU A 107 12.605 6.227 -1.972 1.00 0.00 C ATOM 1650 OE1 GLU A 107 13.101 7.371 -1.876 1.00 0.00 O ATOM 1651 OE2 GLU A 107 12.944 5.237 -1.288 1.00 0.00 O ATOM 0 H GLU A 107 9.918 7.103 -4.621 1.00 0.00 H new ATOM 0 HA GLU A 107 11.494 5.523 -6.435 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.878 5.165 -4.424 1.00 0.00 H new ATOM 0 HB3 GLU A 107 12.539 6.864 -4.688 1.00 0.00 H new ATOM 0 HG2 GLU A 107 10.795 6.843 -2.958 1.00 0.00 H new ATOM 0 HG3 GLU A 107 10.948 5.108 -2.767 1.00 0.00 H new ATOM 1658 N LEU A 108 9.376 4.019 -4.447 1.00 0.00 N ATOM 1659 CA LEU A 108 8.780 2.722 -4.177 1.00 0.00 C ATOM 1660 C LEU A 108 8.258 2.125 -5.475 1.00 0.00 C ATOM 1661 O LEU A 108 8.566 0.976 -5.785 1.00 0.00 O ATOM 1662 CB LEU A 108 7.634 2.846 -3.168 1.00 0.00 C ATOM 1663 CG LEU A 108 8.114 3.124 -1.742 1.00 0.00 C ATOM 1664 CD1 LEU A 108 6.887 3.252 -0.845 1.00 0.00 C ATOM 1665 CD2 LEU A 108 8.989 1.991 -1.208 1.00 0.00 C ATOM 0 H LEU A 108 8.894 4.807 -4.014 1.00 0.00 H new ATOM 0 HA LEU A 108 9.543 2.071 -3.751 1.00 0.00 H new ATOM 0 HB2 LEU A 108 6.967 3.648 -3.483 1.00 0.00 H new ATOM 0 HB3 LEU A 108 7.051 1.925 -3.175 1.00 0.00 H new ATOM 0 HG LEU A 108 8.708 4.038 -1.748 1.00 0.00 H new ATOM 0 HD11 LEU A 108 7.204 3.451 0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.263 4.073 -1.197 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.316 2.324 -0.874 1.00 0.00 H new ATOM 0 HD21 LEU A 108 9.310 2.226 -0.193 1.00 0.00 H new ATOM 0 HD22 LEU A 108 8.418 1.062 -1.202 1.00 0.00 H new ATOM 0 HD23 LEU A 108 9.864 1.875 -1.847 1.00 0.00 H new ATOM 1677 N LEU A 109 7.473 2.900 -6.231 1.00 0.00 N ATOM 1678 CA LEU A 109 6.914 2.391 -7.469 1.00 0.00 C ATOM 1679 C LEU A 109 8.005 2.221 -8.522 1.00 0.00 C ATOM 1680 O LEU A 109 8.103 1.154 -9.125 1.00 0.00 O ATOM 1681 CB LEU A 109 5.798 3.303 -7.973 1.00 0.00 C ATOM 1682 CG LEU A 109 4.617 3.407 -7.006 1.00 0.00 C ATOM 1683 CD1 LEU A 109 3.591 4.386 -7.580 1.00 0.00 C ATOM 1684 CD2 LEU A 109 3.936 2.052 -6.829 1.00 0.00 C ATOM 0 H LEU A 109 7.219 3.862 -6.006 1.00 0.00 H new ATOM 0 HA LEU A 109 6.481 1.410 -7.273 1.00 0.00 H new ATOM 0 HB2 LEU A 109 6.204 4.299 -8.148 1.00 0.00 H new ATOM 0 HB3 LEU A 109 5.440 2.931 -8.933 1.00 0.00 H new ATOM 0 HG LEU A 109 4.990 3.749 -6.041 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.745 4.467 -6.898 1.00 0.00 H new ATOM 0 HD12 LEU A 109 4.053 5.366 -7.704 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.244 4.023 -8.547 1.00 0.00 H new ATOM 0 HD21 LEU A 109 3.100 2.153 -6.137 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.569 1.701 -7.793 1.00 0.00 H new ATOM 0 HD23 LEU A 109 4.653 1.334 -6.430 1.00 0.00 H new ATOM 1696 N SER A 110 8.829 3.246 -8.759 1.00 0.00 N ATOM 1697 CA SER A 110 9.886 3.137 -9.755 1.00 0.00 C ATOM 1698 C SER A 110 10.752 1.898 -9.532 1.00 0.00 C ATOM 1699 O SER A 110 10.973 1.140 -10.474 1.00 0.00 O ATOM 1700 CB SER A 110 10.749 4.396 -9.764 1.00 0.00 C ATOM 1701 OG SER A 110 11.447 4.538 -8.550 1.00 0.00 O ATOM 0 H SER A 110 8.782 4.146 -8.280 1.00 0.00 H new ATOM 0 HA SER A 110 9.406 3.032 -10.728 1.00 0.00 H new ATOM 0 HB2 SER A 110 11.457 4.350 -10.591 1.00 0.00 H new ATOM 0 HB3 SER A 110 10.120 5.271 -9.931 1.00 0.00 H new ATOM 0 HG SER A 110 11.994 5.351 -8.580 1.00 0.00 H new ATOM 1707 N ASP A 111 11.249 1.673 -8.308 1.00 0.00 N ATOM 1708 CA ASP A 111 12.102 0.523 -8.045 1.00 0.00 C ATOM 1709 C ASP A 111 11.317 -0.780 -8.149 1.00 0.00 C ATOM 1710 O ASP A 111 11.784 -1.722 -8.781 1.00 0.00 O ATOM 1711 CB ASP A 111 12.754 0.644 -6.664 1.00 0.00 C ATOM 1712 CG ASP A 111 13.756 1.795 -6.583 1.00 0.00 C ATOM 1713 OD1 ASP A 111 14.310 2.174 -7.643 1.00 0.00 O ATOM 1714 OD2 ASP A 111 13.961 2.290 -5.451 1.00 0.00 O ATOM 0 H ASP A 111 11.074 2.268 -7.498 1.00 0.00 H new ATOM 0 HA ASP A 111 12.886 0.506 -8.802 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.978 0.790 -5.912 1.00 0.00 H new ATOM 0 HB3 ASP A 111 13.260 -0.291 -6.423 1.00 0.00 H new ATOM 1719 N ALA A 112 10.131 -0.846 -7.540 1.00 0.00 N ATOM 1720 CA ALA A 112 9.301 -2.040 -7.557 1.00 0.00 C ATOM 1721 C ALA A 112 9.057 -2.499 -8.987 1.00 0.00 C ATOM 1722 O ALA A 112 9.327 -3.653 -9.305 1.00 0.00 O ATOM 1723 CB ALA A 112 7.962 -1.726 -6.889 1.00 0.00 C ATOM 0 H ALA A 112 9.723 -0.068 -7.021 1.00 0.00 H new ATOM 0 HA ALA A 112 9.813 -2.837 -7.017 1.00 0.00 H new ATOM 0 HB1 ALA A 112 7.333 -2.616 -6.898 1.00 0.00 H new ATOM 0 HB2 ALA A 112 8.134 -1.413 -5.859 1.00 0.00 H new ATOM 0 HB3 ALA A 112 7.463 -0.924 -7.433 1.00 0.00 H new ATOM 1729 N ILE A 113 8.552 -1.614 -9.853 1.00 0.00 N ATOM 1730 CA ILE A 113 8.260 -1.988 -11.226 1.00 0.00 C ATOM 1731 C ILE A 113 9.539 -2.333 -11.976 1.00 0.00 C ATOM 1732 O ILE A 113 9.592 -3.345 -12.673 1.00 0.00 O ATOM 1733 CB ILE A 113 7.549 -0.847 -11.960 1.00 0.00 C ATOM 1734 CG1 ILE A 113 6.377 -0.261 -11.181 1.00 0.00 C ATOM 1735 CG2 ILE A 113 6.936 -1.448 -13.216 1.00 0.00 C ATOM 1736 CD1 ILE A 113 6.100 1.184 -11.568 1.00 0.00 C ATOM 0 H ILE A 113 8.341 -0.643 -9.623 1.00 0.00 H new ATOM 0 HA ILE A 113 7.610 -2.862 -11.196 1.00 0.00 H new ATOM 0 HB ILE A 113 8.285 -0.061 -12.131 1.00 0.00 H new ATOM 0 HG12 ILE A 113 5.486 -0.862 -11.361 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.588 -0.316 -10.113 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.416 -0.670 -13.775 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.724 -1.876 -13.836 1.00 0.00 H new ATOM 0 HG23 ILE A 113 6.229 -2.229 -12.938 1.00 0.00 H new ATOM 0 HD11 ILE A 113 5.257 1.561 -10.988 1.00 0.00 H new ATOM 0 HD12 ILE A 113 6.982 1.791 -11.363 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.862 1.237 -12.630 1.00 0.00 H new ATOM 1748 N ALA A 114 10.573 -1.498 -11.836 1.00 0.00 N ATOM 1749 CA ALA A 114 11.811 -1.694 -12.567 1.00 0.00 C ATOM 1750 C ALA A 114 12.520 -2.971 -12.124 1.00 0.00 C ATOM 1751 O ALA A 114 13.339 -3.504 -12.870 1.00 0.00 O ATOM 1752 CB ALA A 114 12.717 -0.484 -12.361 1.00 0.00 C ATOM 0 H ALA A 114 10.569 -0.683 -11.222 1.00 0.00 H new ATOM 0 HA ALA A 114 11.577 -1.798 -13.626 1.00 0.00 H new ATOM 0 HB1 ALA A 114 13.648 -0.629 -12.909 1.00 0.00 H new ATOM 0 HB2 ALA A 114 12.216 0.412 -12.727 1.00 0.00 H new ATOM 0 HB3 ALA A 114 12.935 -0.370 -11.299 1.00 0.00 H new ATOM 1758 N LYS A 115 12.213 -3.467 -10.919 1.00 0.00 N ATOM 1759 CA LYS A 115 12.828 -4.678 -10.406 1.00 0.00 C ATOM 1760 C LYS A 115 11.964 -5.906 -10.689 1.00 0.00 C ATOM 1761 O LYS A 115 12.436 -7.035 -10.555 1.00 0.00 O ATOM 1762 CB LYS A 115 13.149 -4.481 -8.923 1.00 0.00 C ATOM 1763 CG LYS A 115 12.057 -4.962 -7.965 1.00 0.00 C ATOM 1764 CD LYS A 115 12.644 -5.916 -6.926 1.00 0.00 C ATOM 1765 CE LYS A 115 13.029 -7.280 -7.515 1.00 0.00 C ATOM 1766 NZ LYS A 115 14.391 -7.294 -8.083 1.00 0.00 N ATOM 0 H LYS A 115 11.538 -3.039 -10.285 1.00 0.00 H new ATOM 0 HA LYS A 115 13.767 -4.870 -10.925 1.00 0.00 H new ATOM 0 HB2 LYS A 115 14.075 -5.008 -8.692 1.00 0.00 H new ATOM 0 HB3 LYS A 115 13.332 -3.422 -8.742 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.599 -4.108 -7.466 1.00 0.00 H new ATOM 0 HG3 LYS A 115 11.268 -5.464 -8.525 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.526 -5.458 -6.477 1.00 0.00 H new ATOM 0 HD3 LYS A 115 11.919 -6.064 -6.125 1.00 0.00 H new ATOM 0 HE2 LYS A 115 12.957 -8.040 -6.737 1.00 0.00 H new ATOM 0 HE3 LYS A 115 12.314 -7.550 -8.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 14.818 -8.231 -7.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.344 -7.090 -9.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 14.971 -6.571 -7.611 1.00 0.00 H new ATOM 1780 N SER A 116 10.705 -5.689 -11.079 1.00 0.00 N ATOM 1781 CA SER A 116 9.730 -6.756 -11.235 1.00 0.00 C ATOM 1782 C SER A 116 9.711 -7.356 -12.641 1.00 0.00 C ATOM 1783 O SER A 116 10.266 -6.789 -13.582 1.00 0.00 O ATOM 1784 CB SER A 116 8.365 -6.232 -10.807 1.00 0.00 C ATOM 1785 OG SER A 116 7.824 -5.385 -11.797 1.00 0.00 O ATOM 0 H SER A 116 10.338 -4.762 -11.295 1.00 0.00 H new ATOM 0 HA SER A 116 10.018 -7.587 -10.591 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.689 -7.068 -10.627 1.00 0.00 H new ATOM 0 HB3 SER A 116 8.457 -5.688 -9.867 1.00 0.00 H new ATOM 0 HG SER A 116 8.488 -4.709 -12.047 1.00 0.00 H new ATOM 1791 N ASN A 117 9.061 -8.515 -12.771 1.00 0.00 N ATOM 1792 CA ASN A 117 8.926 -9.240 -14.027 1.00 0.00 C ATOM 1793 C ASN A 117 7.752 -8.674 -14.832 1.00 0.00 C ATOM 1794 O ASN A 117 7.024 -7.816 -14.341 1.00 0.00 O ATOM 1795 CB ASN A 117 8.746 -10.728 -13.703 1.00 0.00 C ATOM 1796 CG ASN A 117 8.928 -11.630 -14.916 1.00 0.00 C ATOM 1797 OD1 ASN A 117 9.401 -11.200 -15.963 1.00 0.00 O ATOM 1798 ND2 ASN A 117 8.550 -12.896 -14.780 1.00 0.00 N ATOM 0 H ASN A 117 8.606 -8.982 -11.987 1.00 0.00 H new ATOM 0 HA ASN A 117 9.817 -9.124 -14.644 1.00 0.00 H new ATOM 0 HB2 ASN A 117 9.462 -11.015 -12.933 1.00 0.00 H new ATOM 0 HB3 ASN A 117 7.751 -10.885 -13.287 1.00 0.00 H new ATOM 0 HD21 ASN A 117 8.649 -13.545 -15.561 1.00 0.00 H new ATOM 0 HD22 ASN A 117 8.160 -13.220 -13.895 1.00 0.00 H new ATOM 1805 N GLN A 118 7.561 -9.145 -16.068 1.00 0.00 N ATOM 1806 CA GLN A 118 6.504 -8.659 -16.946 1.00 0.00 C ATOM 1807 C GLN A 118 5.124 -8.774 -16.294 1.00 0.00 C ATOM 1808 O GLN A 118 4.322 -7.841 -16.367 1.00 0.00 O ATOM 1809 CB GLN A 118 6.556 -9.459 -18.251 1.00 0.00 C ATOM 1810 CG GLN A 118 5.505 -8.971 -19.251 1.00 0.00 C ATOM 1811 CD GLN A 118 5.555 -9.753 -20.561 1.00 0.00 C ATOM 1812 OE1 GLN A 118 6.387 -10.636 -20.750 1.00 0.00 O ATOM 1813 NE2 GLN A 118 4.653 -9.433 -21.486 1.00 0.00 N ATOM 0 H GLN A 118 8.139 -9.875 -16.484 1.00 0.00 H new ATOM 0 HA GLN A 118 6.666 -7.600 -17.147 1.00 0.00 H new ATOM 0 HB2 GLN A 118 7.548 -9.372 -18.693 1.00 0.00 H new ATOM 0 HB3 GLN A 118 6.394 -10.516 -18.038 1.00 0.00 H new ATOM 0 HG2 GLN A 118 4.513 -9.066 -18.810 1.00 0.00 H new ATOM 0 HG3 GLN A 118 5.663 -7.912 -19.455 1.00 0.00 H new ATOM 0 HE21 GLN A 118 3.973 -8.695 -21.302 1.00 0.00 H new ATOM 0 HE22 GLN A 118 4.641 -9.926 -22.379 1.00 0.00 H new ATOM 1822 N ASP A 119 4.832 -9.909 -15.653 1.00 0.00 N ATOM 1823 CA ASP A 119 3.539 -10.091 -15.010 1.00 0.00 C ATOM 1824 C ASP A 119 3.405 -9.167 -13.801 1.00 0.00 C ATOM 1825 O ASP A 119 2.329 -8.631 -13.534 1.00 0.00 O ATOM 1826 CB ASP A 119 3.388 -11.552 -14.590 1.00 0.00 C ATOM 1827 CG ASP A 119 3.431 -12.488 -15.794 1.00 0.00 C ATOM 1828 OD1 ASP A 119 2.380 -12.612 -16.464 1.00 0.00 O ATOM 1829 OD2 ASP A 119 4.513 -13.070 -16.035 1.00 0.00 O ATOM 0 H ASP A 119 5.467 -10.703 -15.569 1.00 0.00 H new ATOM 0 HA ASP A 119 2.747 -9.836 -15.714 1.00 0.00 H new ATOM 0 HB2 ASP A 119 4.185 -11.816 -13.894 1.00 0.00 H new ATOM 0 HB3 ASP A 119 2.445 -11.683 -14.059 1.00 0.00 H new ATOM 1834 N HIS A 120 4.500 -8.973 -13.062 1.00 0.00 N ATOM 1835 CA HIS A 120 4.482 -8.154 -11.863 1.00 0.00 C ATOM 1836 C HIS A 120 4.341 -6.674 -12.214 1.00 0.00 C ATOM 1837 O HIS A 120 3.451 -6.017 -11.679 1.00 0.00 O ATOM 1838 CB HIS A 120 5.738 -8.432 -11.053 1.00 0.00 C ATOM 1839 CG HIS A 120 5.785 -9.831 -10.498 1.00 0.00 C ATOM 1840 ND1 HIS A 120 5.955 -10.998 -11.247 1.00 0.00 N ATOM 1841 CD2 HIS A 120 5.670 -10.154 -9.175 1.00 0.00 C ATOM 1842 CE1 HIS A 120 5.935 -12.000 -10.352 1.00 0.00 C ATOM 1843 NE2 HIS A 120 5.766 -11.524 -9.104 1.00 0.00 N ATOM 0 H HIS A 120 5.411 -9.377 -13.280 1.00 0.00 H new ATOM 0 HA HIS A 120 3.615 -8.412 -11.256 1.00 0.00 H new ATOM 0 HB2 HIS A 120 6.613 -8.267 -11.682 1.00 0.00 H new ATOM 0 HB3 HIS A 120 5.798 -7.719 -10.231 1.00 0.00 H new ATOM 0 HD2 HIS A 120 5.531 -9.470 -8.351 1.00 0.00 H new ATOM 0 HE1 HIS A 120 6.040 -13.046 -10.600 1.00 0.00 H new ATOM 0 HE2 HIS A 120 5.718 -12.083 -8.252 1.00 0.00 H new ATOM 1851 N LYS A 121 5.190 -6.126 -13.097 1.00 0.00 N ATOM 1852 CA LYS A 121 4.999 -4.751 -13.551 1.00 0.00 C ATOM 1853 C LYS A 121 3.602 -4.556 -14.120 1.00 0.00 C ATOM 1854 O LYS A 121 3.011 -3.495 -13.921 1.00 0.00 O ATOM 1855 CB LYS A 121 6.070 -4.352 -14.584 1.00 0.00 C ATOM 1856 CG LYS A 121 5.849 -4.939 -15.977 1.00 0.00 C ATOM 1857 CD LYS A 121 4.981 -4.009 -16.838 1.00 0.00 C ATOM 1858 CE LYS A 121 4.389 -4.739 -18.048 1.00 0.00 C ATOM 1859 NZ LYS A 121 5.441 -5.121 -19.015 1.00 0.00 N ATOM 0 H LYS A 121 5.996 -6.605 -13.500 1.00 0.00 H new ATOM 0 HA LYS A 121 5.108 -4.097 -12.686 1.00 0.00 H new ATOM 0 HB2 LYS A 121 6.097 -3.265 -14.661 1.00 0.00 H new ATOM 0 HB3 LYS A 121 7.047 -4.670 -14.219 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.811 -5.098 -16.465 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.369 -5.914 -15.892 1.00 0.00 H new ATOM 0 HD2 LYS A 121 4.174 -3.600 -16.230 1.00 0.00 H new ATOM 0 HD3 LYS A 121 5.581 -3.166 -17.180 1.00 0.00 H new ATOM 0 HE2 LYS A 121 3.859 -5.631 -17.713 1.00 0.00 H new ATOM 0 HE3 LYS A 121 3.657 -4.098 -18.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 5.008 -5.613 -19.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 5.930 -4.267 -19.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 6.126 -5.752 -18.552 1.00 0.00 H new ATOM 1873 N GLU A 122 3.060 -5.556 -14.821 1.00 0.00 N ATOM 1874 CA GLU A 122 1.720 -5.431 -15.368 1.00 0.00 C ATOM 1875 C GLU A 122 0.695 -5.270 -14.246 1.00 0.00 C ATOM 1876 O GLU A 122 -0.207 -4.437 -14.337 1.00 0.00 O ATOM 1877 CB GLU A 122 1.411 -6.651 -16.236 1.00 0.00 C ATOM 1878 CG GLU A 122 0.073 -6.440 -16.930 1.00 0.00 C ATOM 1879 CD GLU A 122 -0.291 -7.637 -17.804 1.00 0.00 C ATOM 1880 OE1 GLU A 122 0.227 -7.702 -18.942 1.00 0.00 O ATOM 1881 OE2 GLU A 122 -1.086 -8.480 -17.329 1.00 0.00 O ATOM 0 H GLU A 122 3.524 -6.443 -15.017 1.00 0.00 H new ATOM 0 HA GLU A 122 1.663 -4.538 -15.991 1.00 0.00 H new ATOM 0 HB2 GLU A 122 2.199 -6.797 -16.975 1.00 0.00 H new ATOM 0 HB3 GLU A 122 1.379 -7.551 -15.622 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -0.706 -6.281 -16.184 1.00 0.00 H new ATOM 0 HG3 GLU A 122 0.116 -5.539 -17.542 1.00 0.00 H new ATOM 1888 N LYS A 123 0.829 -6.065 -13.181 1.00 0.00 N ATOM 1889 CA LYS A 123 -0.061 -5.958 -12.032 1.00 0.00 C ATOM 1890 C LYS A 123 0.090 -4.614 -11.325 1.00 0.00 C ATOM 1891 O LYS A 123 -0.898 -4.070 -10.842 1.00 0.00 O ATOM 1892 CB LYS A 123 0.223 -7.101 -11.056 1.00 0.00 C ATOM 1893 CG LYS A 123 -0.307 -8.420 -11.629 1.00 0.00 C ATOM 1894 CD LYS A 123 0.016 -9.607 -10.714 1.00 0.00 C ATOM 1895 CE LYS A 123 -0.746 -9.539 -9.388 1.00 0.00 C ATOM 1896 NZ LYS A 123 -2.204 -9.683 -9.585 1.00 0.00 N ATOM 0 H LYS A 123 1.545 -6.787 -13.095 1.00 0.00 H new ATOM 0 HA LYS A 123 -1.088 -6.027 -12.391 1.00 0.00 H new ATOM 0 HB2 LYS A 123 1.295 -7.178 -10.875 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -0.249 -6.896 -10.095 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -1.386 -8.350 -11.766 1.00 0.00 H new ATOM 0 HG3 LYS A 123 0.129 -8.590 -12.613 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -0.232 -10.537 -11.226 1.00 0.00 H new ATOM 0 HD3 LYS A 123 1.087 -9.629 -10.515 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -0.390 -10.326 -8.723 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -0.538 -8.588 -8.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -2.689 -8.840 -9.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -2.409 -9.785 -10.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -2.541 -10.526 -9.077 1.00 0.00 H new ATOM 1910 N ILE A 124 1.308 -4.064 -11.253 1.00 0.00 N ATOM 1911 CA ILE A 124 1.498 -2.771 -10.608 1.00 0.00 C ATOM 1912 C ILE A 124 0.835 -1.692 -11.464 1.00 0.00 C ATOM 1913 O ILE A 124 0.205 -0.774 -10.944 1.00 0.00 O ATOM 1914 CB ILE A 124 2.996 -2.501 -10.399 1.00 0.00 C ATOM 1915 CG1 ILE A 124 3.566 -3.555 -9.448 1.00 0.00 C ATOM 1916 CG2 ILE A 124 3.194 -1.103 -9.800 1.00 0.00 C ATOM 1917 CD1 ILE A 124 5.094 -3.510 -9.396 1.00 0.00 C ATOM 0 H ILE A 124 2.157 -4.488 -11.627 1.00 0.00 H new ATOM 0 HA ILE A 124 1.031 -2.765 -9.623 1.00 0.00 H new ATOM 0 HB ILE A 124 3.513 -2.552 -11.357 1.00 0.00 H new ATOM 0 HG12 ILE A 124 3.164 -3.396 -8.447 1.00 0.00 H new ATOM 0 HG13 ILE A 124 3.243 -4.546 -9.768 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.258 -0.917 -9.654 1.00 0.00 H new ATOM 0 HG22 ILE A 124 2.785 -0.355 -10.479 1.00 0.00 H new ATOM 0 HG23 ILE A 124 2.680 -1.042 -8.841 1.00 0.00 H new ATOM 0 HD11 ILE A 124 5.457 -4.274 -8.709 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.498 -3.695 -10.391 1.00 0.00 H new ATOM 0 HD13 ILE A 124 5.418 -2.528 -9.050 1.00 0.00 H new ATOM 1929 N ARG A 125 0.982 -1.809 -12.789 1.00 0.00 N ATOM 1930 CA ARG A 125 0.399 -0.867 -13.730 1.00 0.00 C ATOM 1931 C ARG A 125 -1.119 -0.843 -13.600 1.00 0.00 C ATOM 1932 O ARG A 125 -1.706 0.235 -13.540 1.00 0.00 O ATOM 1933 CB ARG A 125 0.809 -1.252 -15.153 1.00 0.00 C ATOM 1934 CG ARG A 125 0.382 -0.165 -16.145 1.00 0.00 C ATOM 1935 CD ARG A 125 0.610 -0.636 -17.582 1.00 0.00 C ATOM 1936 NE ARG A 125 -0.306 -1.733 -17.921 1.00 0.00 N ATOM 1937 CZ ARG A 125 -0.900 -1.883 -19.109 1.00 0.00 C ATOM 1938 NH1 ARG A 125 -0.648 -1.046 -20.114 1.00 0.00 N ATOM 1939 NH2 ARG A 125 -1.757 -2.884 -19.302 1.00 0.00 N ATOM 0 H ARG A 125 1.510 -2.562 -13.231 1.00 0.00 H new ATOM 0 HA ARG A 125 0.769 0.134 -13.507 1.00 0.00 H new ATOM 0 HB2 ARG A 125 1.889 -1.393 -15.201 1.00 0.00 H new ATOM 0 HB3 ARG A 125 0.350 -2.202 -15.426 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -0.670 0.078 -15.998 1.00 0.00 H new ATOM 0 HG3 ARG A 125 0.949 0.748 -15.960 1.00 0.00 H new ATOM 0 HD2 ARG A 125 0.460 0.196 -18.271 1.00 0.00 H new ATOM 0 HD3 ARG A 125 1.642 -0.967 -17.702 1.00 0.00 H new ATOM 0 HE ARG A 125 -0.502 -2.428 -17.201 1.00 0.00 H new ATOM 0 HH11 ARG A 125 0.007 -0.275 -19.984 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -1.110 -1.176 -21.014 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -1.960 -3.535 -18.544 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.211 -2.999 -20.208 1.00 0.00 H new ATOM 1953 N MET A 126 -1.764 -2.014 -13.554 1.00 0.00 N ATOM 1954 CA MET A 126 -3.216 -2.056 -13.471 1.00 0.00 C ATOM 1955 C MET A 126 -3.704 -1.639 -12.086 1.00 0.00 C ATOM 1956 O MET A 126 -4.791 -1.078 -11.977 1.00 0.00 O ATOM 1957 CB MET A 126 -3.743 -3.430 -13.914 1.00 0.00 C ATOM 1958 CG MET A 126 -3.502 -4.541 -12.892 1.00 0.00 C ATOM 1959 SD MET A 126 -4.635 -4.532 -11.478 1.00 0.00 S ATOM 1960 CE MET A 126 -3.954 -5.922 -10.542 1.00 0.00 C ATOM 0 H MET A 126 -1.308 -2.926 -13.573 1.00 0.00 H new ATOM 0 HA MET A 126 -3.630 -1.325 -14.165 1.00 0.00 H new ATOM 0 HB2 MET A 126 -4.813 -3.353 -14.108 1.00 0.00 H new ATOM 0 HB3 MET A 126 -3.267 -3.705 -14.855 1.00 0.00 H new ATOM 0 HG2 MET A 126 -3.582 -5.504 -13.397 1.00 0.00 H new ATOM 0 HG3 MET A 126 -2.480 -4.459 -12.521 1.00 0.00 H new ATOM 0 HE1 MET A 126 -4.533 -6.065 -9.630 1.00 0.00 H new ATOM 0 HE2 MET A 126 -4.002 -6.827 -11.148 1.00 0.00 H new ATOM 0 HE3 MET A 126 -2.916 -5.713 -10.284 1.00 0.00 H new ATOM 1970 N LEU A 127 -2.926 -1.896 -11.028 1.00 0.00 N ATOM 1971 CA LEU A 127 -3.283 -1.439 -9.696 1.00 0.00 C ATOM 1972 C LEU A 127 -3.362 0.083 -9.685 1.00 0.00 C ATOM 1973 O LEU A 127 -4.327 0.655 -9.180 1.00 0.00 O ATOM 1974 CB LEU A 127 -2.255 -1.977 -8.691 1.00 0.00 C ATOM 1975 CG LEU A 127 -2.495 -1.499 -7.249 1.00 0.00 C ATOM 1976 CD1 LEU A 127 -1.843 -2.492 -6.288 1.00 0.00 C ATOM 1977 CD2 LEU A 127 -1.873 -0.130 -6.979 1.00 0.00 C ATOM 0 H LEU A 127 -2.050 -2.417 -11.076 1.00 0.00 H new ATOM 0 HA LEU A 127 -4.263 -1.818 -9.407 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -2.275 -3.067 -8.712 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -1.257 -1.670 -9.005 1.00 0.00 H new ATOM 0 HG LEU A 127 -3.573 -1.429 -7.105 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.006 -2.165 -5.261 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.285 -3.478 -6.429 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -0.773 -2.542 -6.488 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -2.070 0.162 -5.948 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.796 -0.181 -7.142 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -2.308 0.607 -7.655 1.00 0.00 H new ATOM 1989 N LEU A 128 -2.345 0.742 -10.245 1.00 0.00 N ATOM 1990 CA LEU A 128 -2.308 2.194 -10.290 1.00 0.00 C ATOM 1991 C LEU A 128 -3.357 2.740 -11.256 1.00 0.00 C ATOM 1992 O LEU A 128 -3.896 3.823 -11.036 1.00 0.00 O ATOM 1993 CB LEU A 128 -0.900 2.634 -10.696 1.00 0.00 C ATOM 1994 CG LEU A 128 0.146 2.176 -9.674 1.00 0.00 C ATOM 1995 CD1 LEU A 128 1.532 2.471 -10.229 1.00 0.00 C ATOM 1996 CD2 LEU A 128 -0.019 2.895 -8.336 1.00 0.00 C ATOM 0 H LEU A 128 -1.538 0.287 -10.672 1.00 0.00 H new ATOM 0 HA LEU A 128 -2.544 2.596 -9.305 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -0.657 2.223 -11.676 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.869 3.720 -10.789 1.00 0.00 H new ATOM 0 HG LEU A 128 0.013 1.108 -9.501 1.00 0.00 H new ATOM 0 HD11 LEU A 128 2.287 2.150 -9.512 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.671 1.933 -11.167 1.00 0.00 H new ATOM 0 HD13 LEU A 128 1.632 3.542 -10.407 1.00 0.00 H new ATOM 0 HD21 LEU A 128 0.741 2.543 -7.638 1.00 0.00 H new ATOM 0 HD22 LEU A 128 0.093 3.969 -8.484 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -1.009 2.686 -7.930 1.00 0.00 H new ATOM 2008 N ASP A 129 -3.655 1.996 -12.329 1.00 0.00 N ATOM 2009 CA ASP A 129 -4.671 2.410 -13.283 1.00 0.00 C ATOM 2010 C ASP A 129 -6.050 2.406 -12.627 1.00 0.00 C ATOM 2011 O ASP A 129 -6.862 3.290 -12.892 1.00 0.00 O ATOM 2012 CB ASP A 129 -4.640 1.483 -14.493 1.00 0.00 C ATOM 2013 CG ASP A 129 -5.654 1.913 -15.547 1.00 0.00 C ATOM 2014 OD1 ASP A 129 -5.391 2.937 -16.217 1.00 0.00 O ATOM 2015 OD2 ASP A 129 -6.684 1.215 -15.677 1.00 0.00 O ATOM 0 H ASP A 129 -3.204 1.108 -12.551 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.462 3.427 -13.615 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -3.640 1.481 -14.927 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -4.852 0.462 -14.177 1.00 0.00 H new ATOM 2512 N PRO B 160 -7.832 -14.481 2.052 1.00 0.00 N ATOM 2513 CA PRO B 160 -9.094 -14.795 1.394 1.00 0.00 C ATOM 2514 C PRO B 160 -9.106 -14.291 -0.051 1.00 0.00 C ATOM 2515 O PRO B 160 -9.134 -15.092 -0.983 1.00 0.00 O ATOM 2516 CB PRO B 160 -10.157 -14.090 2.242 1.00 0.00 C ATOM 2517 CG PRO B 160 -9.411 -12.907 2.868 1.00 0.00 C ATOM 2518 CD PRO B 160 -8.023 -13.489 3.088 1.00 0.00 C ATOM 0 HA PRO B 160 -9.269 -15.869 1.329 1.00 0.00 H new ATOM 0 HB2 PRO B 160 -10.996 -13.755 1.632 1.00 0.00 H new ATOM 0 HB3 PRO B 160 -10.563 -14.754 3.005 1.00 0.00 H new ATOM 0 HG2 PRO B 160 -9.390 -12.041 2.206 1.00 0.00 H new ATOM 0 HG3 PRO B 160 -9.870 -12.583 3.802 1.00 0.00 H new ATOM 0 HD2 PRO B 160 -7.261 -12.712 3.028 1.00 0.00 H new ATOM 0 HD3 PRO B 160 -7.942 -13.939 4.077 1.00 0.00 H new ATOM 2526 N SER B 161 -9.085 -12.967 -0.229 1.00 0.00 N ATOM 2527 CA SER B 161 -9.009 -12.319 -1.531 1.00 0.00 C ATOM 2528 C SER B 161 -8.731 -10.828 -1.340 1.00 0.00 C ATOM 2529 O SER B 161 -9.032 -10.273 -0.282 1.00 0.00 O ATOM 2530 CB SER B 161 -10.330 -12.484 -2.285 1.00 0.00 C ATOM 2531 OG SER B 161 -11.400 -11.956 -1.527 1.00 0.00 O ATOM 0 H SER B 161 -9.121 -12.307 0.547 1.00 0.00 H new ATOM 0 HA SER B 161 -8.207 -12.781 -2.106 1.00 0.00 H new ATOM 0 HB2 SER B 161 -10.272 -11.976 -3.248 1.00 0.00 H new ATOM 0 HB3 SER B 161 -10.509 -13.539 -2.492 1.00 0.00 H new ATOM 0 HG SER B 161 -12.238 -12.067 -2.023 1.00 0.00 H new ATOM 2537 N TYR B 162 -8.157 -10.175 -2.356 1.00 0.00 N ATOM 2538 CA TYR B 162 -7.969 -8.733 -2.325 1.00 0.00 C ATOM 2539 C TYR B 162 -7.806 -8.156 -3.731 1.00 0.00 C ATOM 2540 O TYR B 162 -7.134 -8.745 -4.576 1.00 0.00 O ATOM 2541 CB TYR B 162 -6.738 -8.365 -1.500 1.00 0.00 C ATOM 2542 CG TYR B 162 -6.522 -6.871 -1.492 1.00 0.00 C ATOM 2543 CD1 TYR B 162 -5.812 -6.264 -2.539 1.00 0.00 C ATOM 2544 CD2 TYR B 162 -7.044 -6.096 -0.448 1.00 0.00 C ATOM 2545 CE1 TYR B 162 -5.652 -4.874 -2.568 1.00 0.00 C ATOM 2546 CE2 TYR B 162 -6.894 -4.702 -0.476 1.00 0.00 C ATOM 2547 CZ TYR B 162 -6.207 -4.087 -1.542 1.00 0.00 C ATOM 2548 OH TYR B 162 -6.083 -2.735 -1.576 1.00 0.00 O ATOM 0 H TYR B 162 -7.818 -10.627 -3.205 1.00 0.00 H new ATOM 0 HA TYR B 162 -8.863 -8.308 -1.868 1.00 0.00 H new ATOM 0 HB2 TYR B 162 -6.859 -8.724 -0.478 1.00 0.00 H new ATOM 0 HB3 TYR B 162 -5.859 -8.861 -1.910 1.00 0.00 H new ATOM 0 HD1 TYR B 162 -5.388 -6.871 -3.325 1.00 0.00 H new ATOM 0 HD2 TYR B 162 -7.559 -6.570 0.374 1.00 0.00 H new ATOM 0 HE1 TYR B 162 -5.105 -4.408 -3.374 1.00 0.00 H new ATOM 0 HE2 TYR B 162 -7.305 -4.099 0.320 1.00 0.00 H new ATOM 0 HH TYR B 162 -5.702 -2.463 -2.437 1.00 0.00 H new ATOM 2558 N SER B 163 -8.428 -6.993 -3.971 1.00 0.00 N ATOM 2559 CA SER B 163 -8.359 -6.287 -5.240 1.00 0.00 C ATOM 2560 C SER B 163 -8.249 -4.777 -5.016 1.00 0.00 C ATOM 2561 O SER B 163 -8.869 -4.245 -4.095 1.00 0.00 O ATOM 2562 CB SER B 163 -9.618 -6.578 -6.056 1.00 0.00 C ATOM 2563 OG SER B 163 -9.657 -5.742 -7.194 1.00 0.00 O ATOM 0 H SER B 163 -8.999 -6.517 -3.273 1.00 0.00 H new ATOM 0 HA SER B 163 -7.475 -6.631 -5.777 1.00 0.00 H new ATOM 0 HB2 SER B 163 -9.630 -7.624 -6.362 1.00 0.00 H new ATOM 0 HB3 SER B 163 -10.505 -6.415 -5.443 1.00 0.00 H new ATOM 0 HG SER B 163 -10.538 -5.317 -7.258 1.00 0.00 H new ATOM 2569 N PRO B 164 -7.465 -4.071 -5.846 1.00 0.00 N ATOM 2570 CA PRO B 164 -7.376 -2.617 -5.835 1.00 0.00 C ATOM 2571 C PRO B 164 -8.729 -1.935 -6.035 1.00 0.00 C ATOM 2572 O PRO B 164 -8.828 -0.713 -5.904 1.00 0.00 O ATOM 2573 CB PRO B 164 -6.430 -2.258 -6.984 1.00 0.00 C ATOM 2574 CG PRO B 164 -5.588 -3.518 -7.165 1.00 0.00 C ATOM 2575 CD PRO B 164 -6.588 -4.627 -6.864 1.00 0.00 C ATOM 0 HA PRO B 164 -7.018 -2.271 -4.866 1.00 0.00 H new ATOM 0 HB2 PRO B 164 -6.979 -2.009 -7.892 1.00 0.00 H new ATOM 0 HB3 PRO B 164 -5.811 -1.395 -6.739 1.00 0.00 H new ATOM 0 HG2 PRO B 164 -5.187 -3.596 -8.175 1.00 0.00 H new ATOM 0 HG3 PRO B 164 -4.739 -3.541 -6.482 1.00 0.00 H new ATOM 0 HD2 PRO B 164 -7.147 -4.909 -7.757 1.00 0.00 H new ATOM 0 HD3 PRO B 164 -6.086 -5.526 -6.506 1.00 0.00 H new ATOM 2583 N THR B 165 -9.773 -2.709 -6.348 1.00 0.00 N ATOM 2584 CA THR B 165 -11.110 -2.181 -6.577 1.00 0.00 C ATOM 2585 C THR B 165 -11.677 -1.554 -5.302 1.00 0.00 C ATOM 2586 O THR B 165 -12.412 -0.572 -5.388 1.00 0.00 O ATOM 2587 CB THR B 165 -12.019 -3.305 -7.078 1.00 0.00 C ATOM 2588 OG1 THR B 165 -11.449 -3.929 -8.209 1.00 0.00 O ATOM 2589 CG2 THR B 165 -13.384 -2.751 -7.480 1.00 0.00 C ATOM 0 H THR B 165 -9.708 -3.722 -6.449 1.00 0.00 H new ATOM 0 HA THR B 165 -11.057 -1.397 -7.333 1.00 0.00 H new ATOM 0 HB THR B 165 -12.133 -4.026 -6.268 1.00 0.00 H new ATOM 0 HG1 THR B 165 -12.039 -4.647 -8.519 1.00 0.00 H new ATOM 0 HG21 THR B 165 -14.017 -3.565 -7.834 1.00 0.00 H new ATOM 0 HG22 THR B 165 -13.852 -2.276 -6.618 1.00 0.00 H new ATOM 0 HG23 THR B 165 -13.259 -2.017 -8.276 1.00 0.00 H new